Keyword(s): Human Metabolites
Molecule Category Free-form
UNII HE28T8Z08D
EPA CompTox DTXSID3020546

Structure

InChI Key OAEGRYMCJYIXQT-UHFFFAOYSA-N
Smiles NC(=S)C(=S)N
InChI
InChI=1S/C2H4N2S2/c3-1(5)2(4)6/h(H2,3,5)(H2,4,6)

Physicochemical Descriptors

Property Name Value
Molecular Formula C2H4N2S2
Molecular Weight 119.98
AlogP -0.44
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Polar Surface Area 52.04
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 79-40-3
NORMAN SUSDAT
FDA SRS HE28T8Z08D
PubChem 2777982
ChemSpider 2058248.0