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

Systemtic Name: 2-[[4-[(4-chlorophenyl)methyl]-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[4-[(4-chlorophenyl)methyl]-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[4-[(4-chlorophenyl)methyl]-5-phenyl-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[4-[(4-chlorophenyl)methyl]-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[4-(4-chlorobenzyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N-phenyl-acetamide Formula: C23H19ClN4OS MolecularWeight: 434.94116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2CC3=CC=C(C=C3)Cl)SCC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2CC3=CC=C(C=C3)Cl)SCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H19ClN4OS/c24-19-13-11-17(12-14-19)15-28-22(18-7-3-1-4-8-18)26-27-23(28)30-16-21(29)25-20-9-5-2-6-10-20/h1-14H,15-16H2,(H,25,29)