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

Systemtic Name: 2-[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-yl-ethanamide Openeye Name: 2-[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-naphthyl)acetamide CAS Name: 2-[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]thio]-N-(1-naphthalenyl)acetamide IUPAC Name: 2-[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-ylacetamide Traditional Name: 2-[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]thio]-N-(1-naphthyl)acetamide Formula: C21H17ClN4OS MolecularWeight: 408.90388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC(=CC=C2)Cl)SCC(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=NN=C(N1C2=CC(=CC=C2)Cl)SCC(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H17ClN4OS/c1-14-24-25-21(26(14)17-9-5-8-16(22)12-17)28-13-20(27)23-19-11-4-7-15-6-2-3-10-18(15)19/h2-12H,13H2,1H3,(H,23,27)