N-(cyanomethyl)-N-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-(cyanomethyl)-N-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-(cyanomethyl)-N-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-(cyanomethyl)-N-phenyl-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-(cyanomethyl)-N-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-(cyanomethyl)-N-phenyl-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C12H11N5OS MolecularWeight: 273.31364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N5OS/c13-6-7-17(10-4-2-1-3-5-10)11(18)8-19-12-14-9-15-16-12/h1-5,9H,7-8H2,(H,14,15,16)