Thiram (CHEM003502)

Record Information
Version1.0
Creation Date2014-08-29 06:51:46 UTC
Update Date2026-05-14 19:31:23 UTC
Accession NumberCHEM003502
Identification
Common NameThiram
ClassSmall Molecule
Description
Thiram is an ectoparasiticide. It is used to prevent fungal diseases in seed and crops. It is also used as an animal repellent to protect fruit trees and ornamentals from damage by rabbits, rodents and deer. It is effective against Stem gall of coriander, damping off, smut of millet, neck rot of onion, etc. Thiram has been used in the treatment of human scabies, as a sun screen and as a bactericide applied directly to the skin or incorporated into soap.
Contaminant Sources
  • Clean Air Act Chemicals
  • HPV EPA Chemicals
  • IARC Carcinogens Group 3
  • OECD HPV Chemicals
  • STOFF IDENT Compounds
  • T3DB toxins
  • ToxCast & Tox21 Chemicals
Contaminant Type
  • Amine
  • Cosmetic Toxin
  • Fungicide
  • Household Toxin
  • Organic Compound
  • Pesticide
  • Synthetic Compound
Chemical Structure
MOLSDFPDBSMILESInChI
Synonyms
ValueSource
[Me2nc(S)S]2ChEBI
alpha,Alpha'-dithiobis(dimethylthio)formamideChEBI
ArasanChEBI
Bis((dimethylamino)carbonothioyl) disulfideChEBI
Bis(dimethyl thiocarbamoyl)disulfideChEBI
Bis(dimethyl-thiocarbamoyl)-disulfidChEBI
Bis(dimethylthiocarbamoyl) disulfideChEBI
Disulfure de tetramethylthiourameChEBI
N,N'-(dithiodicarbonothioyl)bis(N-methylmethanamine)ChEBI
N,N-Tetramethylthiuram disulfideChEBI
N(1),N(1),N(3),N(3)-Tetramethyl-2-dithioperoxy-1,3-dithiodicarbonic diamideChEBI
NomersanChEBI
PomarsolChEBI
RezifilmChEBI
Tetramethyl-thiram disulfidChEBI
Tetramethylenethiuram disulfideChEBI
Tetramethylthioperoxydicarbonic diamideChEBI
Tetramethylthiuram disulfideChEBI
Tetramethylthiurane disulfideChEBI
Tetrathiuram disulfideChEBI
ThirameChEBI
ThiramumChEBI
ThiuramChEBI
TiramoChEBI
TMTDChEBI
a,Alpha'-dithiobis(dimethylthio)formamideGenerator
Α,alpha'-dithiobis(dimethylthio)formamideGenerator
Bis((dimethylamino)carbonothioyl) disulphideGenerator
Bis(dimethyl thiocarbamoyl)disulphideGenerator
Bis(dimethyl-thiocarbamoyl)-disulphidGenerator
Bis(dimethylthiocarbamoyl) disulphideGenerator
Disulphure de tetramethylthiourameGenerator
N,N-Tetramethylthiuram disulphideGenerator
Tetramethyl-thiram disulphidGenerator
Tetramethylenethiuram disulphideGenerator
Tetramethylthiuram disulphideGenerator
Tetramethylthiurane disulphideGenerator
Tetrathiuram disulphideGenerator
BacteriostatMeSH
Disulfide, TMTMeSH
Disulfide, tetramethylthiuramMeSH
NobecutanMeSH
Novartis brand OF thiramMeSH
Sadoplon 75MeSH
TMT DisulfideMeSH
Thiram novartis brandMeSH
Thiuram DMeSH
Chemical FormulaC6H12N2S4
Average Molecular Mass240.433 g/mol
Monoisotopic Mass239.988 g/mol
CAS Registry Number137-26-8
IUPAC NameN,N-dimethyl[(dimethylcarbamothioyl)disulfanyl]carbothioamide
Traditional Nametulisan
SMILESCN(C)C(=S)SSC(=S)N(C)C
InChI IdentifierInChI=1S/C6H12N2S4/c1-7(2)5(9)11-12-6(10)8(3)4/h1-4H3
InChI KeyKUAZQDVKQLNFPE-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as thiuram disulfides. These are organic disulfides that have the general structural formula RN(R')C(=S)SSC(=S)N(R\")R\"', where R-R\"'=alkyl groups.
KingdomOrganic compounds
Super ClassOrganic nitrogen compounds
ClassOrganonitrogen compounds
Sub ClassAmines
Direct ParentThiuram disulfides
Alternative Parents
Substituents
  • Thiuram disulfide
  • Organic disulfide
  • Sulfenyl compound
  • Organopnictogen compound
  • Hydrocarbon derivative
  • Organosulfur compound
  • Aliphatic acyclic compound
Molecular FrameworkAliphatic acyclic compounds
External Descriptors
Biological Properties
StatusDetected and Not Quantified
OriginExogenous
Cellular Locations
  • Extracellular
  • Extracellular matrix
  • Membrane
  • Microsome
  • Mitochondrion
  • Plasma Membrane
Biofluid LocationsNot Available
Tissue LocationsNot Available
Pathways
NameSMPDB LinkKEGG Link
Oxidative phosphorylationNot Availablemap00190
ApoptosisNot Availablemap04210
Antifungal AgentsNot AvailableNot Available
Applications
Biological Roles
Chemical RolesNot Available
Physical Properties
StateSolid
AppearanceWhite powder.
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted Properties
PropertyValueSource
Water Solubility0.044 g/LALOGPS
logP2.18ALOGPS
logP2.73ChemAxon
logS-3.7ALOGPS
Physiological Charge0ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area6.48 ŲChemAxon
Rotatable Bond Count3ChemAxon
Refractivity69.24 m³·mol⁻¹ChemAxon
Polarizability23.96 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
Spectra
Spectra
Toxicity Profile
Route of ExposureNot Available
Mechanism of ToxicityNot Available
MetabolismNot Available
Toxicity ValuesNot Available
Lethal DoseNot Available
Carcinogenicity (IARC Classification)3, not classifiable as to its carcinogenicity to humans. (1)
Uses/SourcesThis is a man-made compound that is used as a pesticide.
Minimum Risk LevelNot Available
Health EffectsNot Available
SymptomsNot Available
TreatmentNot Available
Concentrations
Not Available
External Links
DrugBank IDDB13245
HMDB IDHMDB0259039
FooDB IDNot Available
Phenol Explorer IDNot Available
KNApSAcK IDNot Available
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkThiram
Chemspider ID5256
ChEBI ID9495
PubChem Compound IDNot Available
Kegg Compound IDC11160
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General References
1. https://www.ncbi.nlm.nih.gov/pubmed/?term=14587840
2. https://www.ncbi.nlm.nih.gov/pubmed/?term=1842585
3. https://www.ncbi.nlm.nih.gov/pubmed/?term=20940038
4. https://www.ncbi.nlm.nih.gov/pubmed/?term=3055654
5. https://www.ncbi.nlm.nih.gov/pubmed/?term=3176026