2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-phenylpropyl)ethanamide

Systemtic Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-phenylpropyl)ethanamide Openeye Name: 2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-phenylpropyl)acetamide CAS Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-phenylpropyl)acetamide Traditional Name: 2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]-N-(3-phenylpropyl)acetamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SCC(=O)NCCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SCC(=O)NCCCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4OS/c1-16-8-5-6-12-18(16)24-15-22-23-20(24)26-14-19(25)21-13-7-11-17-9-3-2-4-10-17/h2-6,8-10,12,15H,7,11,13-14H2,1H3,(H,21,25)