2-[[4-cyclohexyl-5-(1-phenoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(diphenylmethyl)ethanamide

Systemtic Name: 2-[[4-cyclohexyl-5-(1-phenoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(diphenylmethyl)ethanamide Openeye Name: N-benzhydryl-2-[[4-cyclohexyl-5-(1-phenoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-cyclohexyl-5-(1-phenoxyethyl)-1,2,4-triazol-3-yl]thio]-N-(diphenylmethyl)acetamide IUPAC Name: N-benzhydryl-2-[[4-cyclohexyl-5-(1-phenoxyethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-benzhydryl-2-[[4-cyclohexyl-5-(1-phenoxyethyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C31H34N4O2S MolecularWeight: 526.69226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(N1C2CCCCC2)SCC(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

CC(C1=NN=C(N1C2CCCCC2)SCC(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C31H34N4O2S/c1-23(37-27-20-12-5-13-21-27)30-33-34-31(35(30)26-18-10-4-11-19-26)38-22-28(36)32-29(24-14-6-2-7-15-24)25-16-8-3-9-17-25/h2-3,5-9,12-17,20-21,23,26,29H,4,10-11,18-19,22H2,1H3,(H,32,36)