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

Systemtic Name: 2-[[4-(4-chlorophenyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[4-(4-chlorophenyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[4-(4-chlorophenyl)-5-phenethyl-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[4-(4-chlorophenyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[4-(4-chlorophenyl)-5-phenethyl-1,2,4-triazol-3-yl]thio]-N-phenyl-acetamide Formula: C24H21ClN4OS MolecularWeight: 448.96774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C24H21ClN4OS/c25-19-12-14-21(15-13-19)29-22(16-11-18-7-3-1-4-8-18)27-28-24(29)31-17-23(30)26-20-9-5-2-6-10-20/h1-10,12-15H,11,16-17H2,(H,26,30)