2-cyclopentyl-N-[[4-(2-methylpropyl)-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]ethanamide

Systemtic Name: 2-cyclopentyl-N-[[4-(2-methylpropyl)-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]ethanamide Openeye Name: 2-cyclopentyl-N-[[4-isobutyl-5-(4-pyridylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]acetamide CAS Name: 2-cyclopentyl-N-[[4-(2-methylpropyl)-5-(pyridin-4-ylmethylthio)-1,2,4-triazol-3-yl]methyl]acetamide IUPAC Name: 2-cyclopentyl-N-[[4-(2-methylpropyl)-5-(pyridin-4-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]acetamide Traditional Name: 2-cyclopentyl-N-[[4-isobutyl-5-(4-pyridylmethylthio)-1,2,4-triazol-3-yl]methyl]acetamide Formula: C20H29N5OS MolecularWeight: 387.54216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SCC2=CC=NC=C2)CNC(=O)CC3CCCC3

Isomeric SMILES

CC(C)CN1C(=NN=C1SCC2=CC=NC=C2)CNC(=O)CC3CCCC3

InChI

InChI=1S/C20H29N5OS/c1-15(2)13-25-18(12-22-19(26)11-16-5-3-4-6-16)23-24-20(25)27-14-17-7-9-21-10-8-17/h7-10,15-16H,3-6,11-14H2,1-2H3,(H,22,26)