N-propan-2-yl-1-[2-[1-(2-pyridin-2-ylsulfanylethanoyl)piperidin-2-yl]ethyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-propan-2-yl-1-[2-[1-(2-pyridin-2-ylsulfanylethanoyl)piperidin-2-yl]ethyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-isopropyl-1-[2-[1-[2-(2-pyridylsulfanyl)acetyl]-2-piperidyl]ethyl]triazole-4-carboxamide CAS Name: 1-[2-[1-[1-oxo-2-(2-pyridinylthio)ethyl]-2-piperidinyl]ethyl]-N-propan-2-yl-4-triazolecarboxamide IUPAC Name: N-propan-2-yl-1-[2-[1-(2-pyridin-2-ylsulfanylacetyl)piperidin-2-yl]ethyl]triazole-4-carboxamide Traditional Name: N-isopropyl-1-[2-[1-[2-(2-pyridylthio)acetyl]-2-piperidyl]ethyl]triazole-4-carboxamide Formula: C20H28N6O2S MolecularWeight: 416.54032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CN(N=N1)CCC2CCCCN2C(=O)CSC3=CC=CC=N3

Isomeric SMILES

CC(C)NC(=O)C1=CN(N=N1)CCC2CCCCN2C(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C20H28N6O2S/c1-15(2)22-20(28)17-13-25(24-23-17)12-9-16-7-4-6-11-26(16)19(27)14-29-18-8-3-5-10-21-18/h3,5,8,10,13,15-16H,4,6-7,9,11-12,14H2,1-2H3,(H,22,28)