2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(diphenylmethyl)-N-methyl-ethanamide

Systemtic Name: 2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(diphenylmethyl)-N-methyl-ethanamide Openeye Name: N-benzhydryl-2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-acetamide CAS Name: 2-[[4-cyclopropyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-(diphenylmethyl)-N-methylacetamide IUPAC Name: N-benzhydryl-2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-methylacetamide Traditional Name: N-benzhydryl-2-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-methyl-acetamide Formula: C26H25N5OS MolecularWeight: 455.5746

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)CSC3=NN=C(N3C4CC4)C5=CN=CC=C5

Isomeric SMILES

CN(C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)CSC3=NN=C(N3C4CC4)C5=CN=CC=C5

InChI

InChI=1S/C26H25N5OS/c1-30(24(19-9-4-2-5-10-19)20-11-6-3-7-12-20)23(32)18-33-26-29-28-25(31(26)22-14-15-22)21-13-8-16-27-17-21/h2-13,16-17,22,24H,14-15,18H2,1H3