2-(4-methylphenyl)sulfanyl-N-(1H-1,2,4-triazol-5-yl)ethanamide

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-(1H-1,2,4-triazol-5-yl)ethanamide Openeye Name: 2-(p-tolylsulfanyl)-N-(1H-1,2,4-triazol-5-yl)acetamide CAS Name: 2-[(4-methylphenyl)thio]-N-(1H-1,2,4-triazol-5-yl)acetamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-(1H-1,2,4-triazol-5-yl)acetamide Traditional Name: 2-(p-tolylthio)-N-(1H-1,2,4-triazol-5-yl)acetamide Formula: C11H12N4OS MolecularWeight: 248.30418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=NC=NN2

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=NC=NN2

InChI

InChI=1S/C11H12N4OS/c1-8-2-4-9(5-3-8)17-6-10(16)14-11-12-7-13-15-11/h2-5,7H,6H2,1H3,(H2,12,13,14,15,16)