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

Systemtic Name: N-propan-2-yl-1-[1-(2-pyridin-2-ylsulfanylethanoyl)piperidin-4-yl]-1,2,3-triazole-4-carboxamide Openeye Name: N-isopropyl-1-[1-[2-(2-pyridylsulfanyl)acetyl]-4-piperidyl]triazole-4-carboxamide CAS Name: 1-[1-[1-oxo-2-(2-pyridinylthio)ethyl]-4-piperidinyl]-N-propan-2-yl-4-triazolecarboxamide IUPAC Name: N-propan-2-yl-1-[1-(2-pyridin-2-ylsulfanylacetyl)piperidin-4-yl]triazole-4-carboxamide Traditional Name: N-isopropyl-1-[1-[2-(2-pyridylthio)acetyl]-4-piperidyl]triazole-4-carboxamide Formula: C18H24N6O2S MolecularWeight: 388.48716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CN(N=N1)C2CCN(CC2)C(=O)CSC3=CC=CC=N3

Isomeric SMILES

CC(C)NC(=O)C1=CN(N=N1)C2CCN(CC2)C(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C18H24N6O2S/c1-13(2)20-18(26)15-11-24(22-21-15)14-6-9-23(10-7-14)17(25)12-27-16-5-3-4-8-19-16/h3-5,8,11,13-14H,6-7,9-10,12H2,1-2H3,(H,20,26)