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

Systemtic Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanamide Openeye Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-acetamide CAS Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]thio]-2-phenylacetamide IUPAC Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-2-phenylacetamide Traditional Name: 2-[[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]thio]-2-phenyl-acetamide Formula: C16H13ClN4OS MolecularWeight: 344.81862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)N)SC2=NNC(=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)N)SC2=NNC(=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN4OS/c17-12-8-6-11(7-9-12)15-19-16(21-20-15)23-13(14(18)22)10-4-2-1-3-5-10/h1-9,13H,(H2,18,22)(H,19,20,21)