5-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)pentanamide

Systemtic Name: 5-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)pentanamide Openeye Name: 5-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)pentanamide CAS Name: 5-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N-(1-phenylethyl)pentanamide IUPAC Name: 5-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)pentanamide Traditional Name: 5-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N-(1-phenylethyl)valeramide Formula: C28H30N4O2S MolecularWeight: 486.6284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CCCCSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CCCCSC2=NN=C(N2C3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C28H30N4O2S/c1-21(22-11-5-3-6-12-22)29-26(33)15-9-10-20-35-28-31-30-27(23-13-7-4-8-14-23)32(28)24-16-18-25(34-2)19-17-24/h3-8,11-14,16-19,21H,9-10,15,20H2,1-2H3,(H,29,33)