4-amino-3-propylsulfanylthieno[3,2-d][1,2]thiazole-5-carbonitrile (CED0316349)

Record Information

Version

1.0

Creation Date

2026-09-01 17:36:21 UTC

Update Date

2026-09-01 17:36:21 UTC

SynCED ID

CED0316349

Secondary Accession Numbers

CHEM362329

Identification

Common Name

4-amino-3-propylsulfanylthieno[3,2-d][1,2]thiazole-5-carbonitrile

Class

Small Molecule

Description

4-amino-3-propylsulfanylthieno[3,2-d][1,2]thiazole-5-carbonitrile is a chemical compound with the formula C9H9N3S3. It has an average molecular weight of 255.40 g/mol.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₉H₉N₃S₃

Average Molecular Mass

Not Available

Monoisotopic Mass

254.996 g/mol

CAS Registry Number

135489-14-4

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

CCCSC1=NSC2=C1C(=C(S2)C#N)N

InChI Identifier

InChI=1S/C9H9N3S3/c1-2-3-13-8-6-7(11)5(4-10)14-9(6)15-12-8/h2-3,11H2,1H3

InChI Key

SLHGZBUPFKMRSY-UHFFFAOYSA-N

Chemical Taxonomy

Classification

Not classified

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Not Available

Spectra

Not Available

Toxicity Profile

Toxicity Values

Toxicity Value	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Toxicity Rating	Reference
700.0 Log mg/kg [390:1200]	Rat	LD50	oral	predicted	Not Available	Not Available

Toxicity / Toxin Class

Not Available

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Health Effects

Health Effect	Relationship	Direction	Description	Reference

Exposure Sources

Source ID	Source	Sector	Reference
No Sources linked to this compound

Pathways

0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Mitogen-activated protein kinase 8	P45983	Humans	Predicted (SEA)	Prediction Confidence Score 0.183 Applicability Domain 0.203 Low confidence Statistical Significance 0.9288 Supporting Reference Compounds 782 E-value 7230.32
Click to view 3D structure	Mitogen-activated protein kinase 9	P45984	Humans	Predicted (SEA)	Prediction Confidence Score 0.181 Applicability Domain 0.203 Low confidence Statistical Significance 0.9304 Supporting Reference Compounds 758 E-value 7243.4
Click to view 3D structure	Hepatocyte growth factor receptor	P08581	Humans	Predicted (SEA)	Prediction Confidence Score 0.18 Applicability Domain 0.203 Low confidence Statistical Significance 0.9438 Supporting Reference Compounds 934 E-value 7347.57
Click to view 3D structure	Insulin receptor	P06213	Humans	Predicted (SEA)	Prediction Confidence Score 0.18 Applicability Domain 0.203 Low confidence Statistical Significance 0.9448 Supporting Reference Compounds 772 E-value 7355.12
Click to view 3D structure	Ephrin type-A receptor 2	P29317	Humans	Predicted (SEA)	Prediction Confidence Score 0.18 Applicability Domain 0.203 Low confidence Statistical Significance 0.9351 Supporting Reference Compounds 611 E-value 7279.68
Click to view 3D structure	Serine/threonine-protein kinase D3	O94806	Humans	Predicted (SEA)	Prediction Confidence Score 0.179 Applicability Domain 0.203 Low confidence Statistical Significance 0.9237 Supporting Reference Compounds 628 E-value 7191.01
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q99720	Humans	Predicted (SEA)	Prediction Confidence Score 0.178 Applicability Domain 0.254 Low confidence Statistical Significance 0.917 Supporting Reference Compounds 562 E-value 7138.7
Click to view 3D structure	Glycogen synthase kinase-3 beta	P49841	Humans	Predicted (SEA)	Prediction Confidence Score 0.174 Applicability Domain 0.203 Low confidence Statistical Significance 0.971 Supporting Reference Compounds 1157 E-value 7559.16
Click to view 3D structure	Dual specificity tyrosine-phosphorylation-regulated kinase 1A	Q13627	Humans	Predicted (SEA)	Prediction Confidence Score 0.174 Applicability Domain 0.203 Low confidence Statistical Significance 0.9568 Supporting Reference Compounds 906 E-value 7448.92
Click to view 3D structure	Cyclin-dependent kinase 5	Q00535	Humans	Predicted (SEA)	Prediction Confidence Score 0.174 Applicability Domain 0.203 Low confidence Statistical Significance 0.954 Supporting Reference Compounds 779 E-value 7426.66
Click to view 3D structure	Fibroblast growth factor receptor 1	P11362	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9587 Supporting Reference Compounds 1010 E-value 7463.4
Click to view 3D structure	Serine/threonine-protein kinase PAK 4	O96013	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9508 Supporting Reference Compounds 728 E-value 7401.59
Click to view 3D structure	BDNF/NT-3 growth factors receptor	Q16620	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9495 Supporting Reference Compounds 721 E-value 7392.17
Click to view 3D structure	cAMP-dependent protein kinase catalytic subunit alpha	P17612	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9573 Supporting Reference Compounds 735 E-value 7452.82
Click to view 3D structure	Serine/threonine-protein kinase pim-1	P11309	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9609 Supporting Reference Compounds 967 E-value 7480.22
Click to view 3D structure	Ribosomal protein S6 kinase alpha-3	P51812	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9533 Supporting Reference Compounds 733 E-value 7421.05
Click to view 3D structure	Vascular endothelial growth factor receptor 2	P35968	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.973 Supporting Reference Compounds 1660 E-value 7574.88
Click to view 3D structure	Glycogen synthase kinase-3 alpha	P49840	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9536 Supporting Reference Compounds 754 E-value 7423.47
Click to view 3D structure	Rho-associated protein kinase 2	O75116	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9617 Supporting Reference Compounds 811 E-value 7486.53
Click to view 3D structure	Serine/threonine-protein kinase Chk1	O14757	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9558 Supporting Reference Compounds 807 E-value 7441.14
Click to view 3D structure	Rho-associated protein kinase 1	Q13464	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9567 Supporting Reference Compounds 834 E-value 7448.15
Click to view 3D structure	Protein kinase C delta type	Q05655	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9518 Supporting Reference Compounds 681 E-value 7409.61
Click to view 3D structure	RAC-alpha serine/threonine-protein kinase	P31749	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9637 Supporting Reference Compounds 797 E-value 7502.41
Click to view 3D structure	Serine/threonine-protein kinase D2	Q9BZL6	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9428 Supporting Reference Compounds 604 E-value 7339.39
Click to view 3D structure	3-phosphoinositide-dependent protein kinase 1	O15530	Humans	Predicted (SEA)	Prediction Confidence Score 0.173 Applicability Domain 0.203 Low confidence Statistical Significance 0.9432 Supporting Reference Compounds 591 E-value 7342.82