4-(2-cyanoethylsulfanyl)pyridine-2-carbothioamide

Systemtic Name: 4-(2-cyanoethylsulfanyl)pyridine-2-carbothioamide Openeye Name: 4-(2-cyanoethylsulfanyl)pyridine-2-carbothioamide CAS Name: 4-(2-cyanoethylthio)-2-pyridinecarbothioamide IUPAC Name: 4-(2-cyanoethylsulfanyl)pyridine-2-carbothioamide Traditional Name: 4-(2-cyanoethylthio)thiopicolinamide Formula: C9H9N3S2 MolecularWeight: 223.31786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C=C1SCCC#N)C(=S)N

Isomeric SMILES

C1=CN=C(C=C1SCCC#N)C(=S)N

InChI

InChI=1S/C9H9N3S2/c10-3-1-5-14-7-2-4-12-8(6-7)9(11)13/h2,4,6H,1,5H2,(H2,11,13)