1-(4-methoxyphenyl)-N-[[4-(3-methoxyphenyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]cyclopentane-1-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)-N-[[4-(3-methoxyphenyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]cyclopentane-1-carboxamide Openeye Name: 1-(4-methoxyphenyl)-N-[[4-(3-methoxyphenyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]cyclopentanecarboxamide CAS Name: 1-(4-methoxyphenyl)-N-[[4-(3-methoxyphenyl)-5-(phenethylthio)-1,2,4-triazol-3-yl]methyl]-1-cyclopentanecarboxamide IUPAC Name: 1-(4-methoxyphenyl)-N-[[4-(3-methoxyphenyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]cyclopentane-1-carboxamide Traditional Name: 1-(4-methoxyphenyl)-N-[[4-(3-methoxyphenyl)-5-(phenethylthio)-1,2,4-triazol-3-yl]methyl]cyclopentanecarboxamide Formula: C31H34N4O3S MolecularWeight: 542.69166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CCCC2)C(=O)NCC3=NN=C(N3C4=CC(=CC=C4)OC)SCCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2(CCCC2)C(=O)NCC3=NN=C(N3C4=CC(=CC=C4)OC)SCCC5=CC=CC=C5

InChI

InChI=1S/C31H34N4O3S/c1-37-26-15-13-24(14-16-26)31(18-6-7-19-31)29(36)32-22-28-33-34-30(39-20-17-23-9-4-3-5-10-23)35(28)25-11-8-12-27(21-25)38-2/h3-5,8-16,21H,6-7,17-20,22H2,1-2H3,(H,32,36)