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

Systemtic Name: 2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-2-phenyl-ethanamide Openeye Name: 2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-2-phenyl-acetamide CAS Name: 2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-cyclopropyl-2-phenylacetamide IUPAC Name: 2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-cyclopropyl-2-phenylacetamide Traditional Name: 2-[[5-(4-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-cyclopropyl-2-phenyl-acetamide Formula: C25H21ClN4OS MolecularWeight: 460.97844

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)SC3=NN=C(N3C4=CC=CC=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CC1NC(=O)C(C2=CC=CC=C2)SC3=NN=C(N3C4=CC=CC=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H21ClN4OS/c26-19-13-11-18(12-14-19)23-28-29-25(30(23)21-9-5-2-6-10-21)32-22(17-7-3-1-4-8-17)24(31)27-20-15-16-20/h1-14,20,22H,15-16H2,(H,27,31)