2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(cyanomethylsulfanyl)phenyl]ethanamide

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(cyanomethylsulfanyl)phenyl]ethanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(cyanomethylsulfanyl)phenyl]acetamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-[2-(cyanomethylthio)phenyl]acetamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(cyanomethylsulfanyl)phenyl]acetamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-[2-(cyanomethylthio)phenyl]acetamide Formula: C12H12N6OS2 MolecularWeight: 320.39328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CSC2=NNC(=N2)N)SCC#N

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CSC2=NNC(=N2)N)SCC#N

InChI

InChI=1S/C12H12N6OS2/c13-5-6-20-9-4-2-1-3-8(9)15-10(19)7-21-12-16-11(14)17-18-12/h1-4H,6-7H2,(H,15,19)(H3,14,16,17,18)