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

Systemtic Name: 2-cyclopentyl-N-[[4-(3-methoxyphenyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]ethanamide Openeye Name: 2-cyclopentyl-N-[[4-(3-methoxyphenyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]acetamide CAS Name: 2-cyclopentyl-N-[[4-(3-methoxyphenyl)-5-(phenethylthio)-1,2,4-triazol-3-yl]methyl]acetamide IUPAC Name: 2-cyclopentyl-N-[[4-(3-methoxyphenyl)-5-phenethylsulfanyl-1,2,4-triazol-3-yl]methyl]acetamide Traditional Name: 2-cyclopentyl-N-[[4-(3-methoxyphenyl)-5-(phenethylthio)-1,2,4-triazol-3-yl]methyl]acetamide Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=NN=C2SCCC3=CC=CC=C3)CNC(=O)CC4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=NN=C2SCCC3=CC=CC=C3)CNC(=O)CC4CCCC4

InChI

InChI=1S/C25H30N4O2S/c1-31-22-13-7-12-21(17-22)29-23(18-26-24(30)16-20-10-5-6-11-20)27-28-25(29)32-15-14-19-8-3-2-4-9-19/h2-4,7-9,12-13,17,20H,5-6,10-11,14-16,18H2,1H3,(H,26,30)