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

Systemtic Name: N-(2-cyanoethyl)-N-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-(2-cyanoethyl)-N-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-(2-cyanoethyl)-N-phenyl-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-(2-cyanoethyl)-N-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-(2-cyanoethyl)-N-phenyl-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C13H13N5OS MolecularWeight: 287.34022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N5OS/c14-7-4-8-18(11-5-2-1-3-6-11)12(19)9-20-13-15-10-16-17-13/h1-3,5-6,10H,4,8-9H2,(H,15,16,17)