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

Systemtic Name: N-(2,5-dimethylphenyl)-2-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-(2,5-dimethylphenyl)-2-phenyl-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-phenyl-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-(2,5-dimethylphenyl)-2-phenyl-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=NC=NN3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)SC3=NC=NN3

InChI

InChI=1S/C18H18N4OS/c1-12-8-9-13(2)15(10-12)21-17(23)16(14-6-4-3-5-7-14)24-18-19-11-20-22-18/h3-11,16H,1-2H3,(H,21,23)(H,19,20,22)