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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]-2-phenylacetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenylacetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[(4-cyclopropyl-1,2,4-triazol-3-yl)thio]-2-phenyl-acetamide Formula: C20H19ClN4OS MolecularWeight: 398.90906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NN=CN3C4CC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=NN=CN3C4CC4)Cl

InChI

InChI=1S/C20H19ClN4OS/c1-13-7-8-15(11-17(13)21)23-19(26)18(14-5-3-2-4-6-14)27-20-24-22-12-25(20)16-9-10-16/h2-8,11-12,16,18H,9-10H2,1H3,(H,23,26)