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

Systemtic Name: N-(2-cyanoethyl)-N-(4-methylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-(2-cyanoethyl)-N-(p-tolyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-(2-cyanoethyl)-N-(4-methylphenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-(2-cyanoethyl)-N-(4-methylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-(2-cyanoethyl)-N-(p-tolyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C14H15N5OS MolecularWeight: 301.3668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=NC=NN2

Isomeric SMILES

CC1=CC=C(C=C1)N(CCC#N)C(=O)CSC2=NC=NN2

InChI

InChI=1S/C14H15N5OS/c1-11-3-5-12(6-4-11)19(8-2-7-15)13(20)9-21-14-16-10-17-18-14/h3-6,10H,2,8-9H2,1H3,(H,16,17,18)