1-[3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]-2-pyridin-4-ylsulfanyl-ethanone

Systemtic Name: 1-[3-[(4-propan-2-ylphenyl)amino]piperidin-1-yl]-2-pyridin-4-ylsulfanyl-ethanone Openeye Name: 1-[3-(4-isopropylanilino)-1-piperidyl]-2-(4-pyridylsulfanyl)ethanone CAS Name: 1-[3-(4-propan-2-ylanilino)-1-piperidinyl]-2-(pyridin-4-ylthio)ethanone IUPAC Name: 1-[3-(4-propan-2-ylanilino)piperidin-1-yl]-2-pyridin-4-ylsulfanylethanone Traditional Name: 1-(3-cumidinopiperidino)-2-(4-pyridylthio)ethanone Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2CCCN(C2)C(=O)CSC3=CC=NC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2CCCN(C2)C(=O)CSC3=CC=NC=C3

InChI

InChI=1S/C21H27N3OS/c1-16(2)17-5-7-18(8-6-17)23-19-4-3-13-24(14-19)21(25)15-26-20-9-11-22-12-10-20/h5-12,16,19,23H,3-4,13-15H2,1-2H3