N-[1-(phenylcarbamoyl)piperidin-4-yl]-2-propan-2-ylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[1-(phenylcarbamoyl)piperidin-4-yl]-2-propan-2-ylsulfanyl-pyridine-3-carboxamide Openeye Name: 2-isopropylsulfanyl-N-[1-(phenylcarbamoyl)-4-piperidyl]pyridine-3-carboxamide CAS Name: N-[1-[anilino(oxo)methyl]-4-piperidinyl]-2-(propan-2-ylthio)-3-pyridinecarboxamide IUPAC Name: N-[1-(phenylcarbamoyl)piperidin-4-yl]-2-propan-2-ylsulfanylpyridine-3-carboxamide Traditional Name: 2-(isopropylthio)-N-[1-(phenylcarbamoyl)-4-piperidyl]nicotinamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=C(C=CC=N1)C(=O)NC2CCN(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)SC1=C(C=CC=N1)C(=O)NC2CCN(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H26N4O2S/c1-15(2)28-20-18(9-6-12-22-20)19(26)23-17-10-13-25(14-11-17)21(27)24-16-7-4-3-5-8-16/h3-9,12,15,17H,10-11,13-14H2,1-2H3,(H,23,26)(H,24,27)