2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-2-yl-ethanamide

Systemtic Name: 2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-2-yl-ethanamide Openeye Name: 2-[[5-(m-tolyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-naphthyl)acetamide CAS Name: 2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(2-naphthalenyl)acetamide IUPAC Name: 2-[[5-(3-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-2-ylacetamide Traditional Name: 2-[[5-(m-tolyl)-1H-1,2,4-triazol-3-yl]thio]-N-(2-naphthyl)acetamide Formula: C21H18N4OS MolecularWeight: 374.45882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=NN2)SCC(=O)NC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=NN2)SCC(=O)NC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H18N4OS/c1-14-5-4-8-17(11-14)20-23-21(25-24-20)27-13-19(26)22-18-10-9-15-6-2-3-7-16(15)12-18/h2-12H,13H2,1H3,(H,22,26)(H,23,24,25)