N-[2-(cyanomethylsulfanyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-[2-(cyanomethylthio)phenyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-[2-(cyanomethylsulfanyl)phenyl]-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-[2-(cyanomethylthio)phenyl]-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C12H11N5OS2 MolecularWeight: 305.37864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CSC2=NC=NN2)SCC#N

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CSC2=NC=NN2)SCC#N

InChI

InChI=1S/C12H11N5OS2/c13-5-6-19-10-4-2-1-3-9(10)16-11(18)7-20-12-14-8-15-17-12/h1-4,8H,6-7H2,(H,16,18)(H,14,15,17)