6-methyl-3-[(4-methylpiperidin-1-yl)-(4-methylsulfanylphenyl)methyl]-2-oxidanyl-1-(pyridin-3-ylmethyl)pyridin-4-one

Systemtic Name: 6-methyl-3-[(4-methylpiperidin-1-yl)-(4-methylsulfanylphenyl)methyl]-2-oxidanyl-1-(pyridin-3-ylmethyl)pyridin-4-one Openeye Name: 2-hydroxy-6-methyl-3-[(4-methyl-1-piperidyl)-(4-methylsulfanylphenyl)methyl]-1-(3-pyridylmethyl)pyridin-4-one CAS Name: 2-hydroxy-6-methyl-3-[(4-methyl-1-piperidinyl)-[4-(methylthio)phenyl]methyl]-1-(3-pyridinylmethyl)-4-pyridinone IUPAC Name: 2-hydroxy-6-methyl-3-[(4-methylpiperidin-1-yl)-(4-methylsulfanylphenyl)methyl]-1-(pyridin-3-ylmethyl)pyridin-4-one Traditional Name: 2-hydroxy-6-methyl-3-[(4-methylpiperidino)-[4-(methylthio)phenyl]methyl]-1-(3-pyridylmethyl)-4-pyridone Formula: C26H31N3O2S MolecularWeight: 449.60824

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(C2=CC=C(C=C2)SC)C3=C(N(C(=CC3=O)C)CC4=CN=CC=C4)O

Isomeric SMILES

CC1CCN(CC1)C(C2=CC=C(C=C2)SC)C3=C(N(C(=CC3=O)C)CC4=CN=CC=C4)O

InChI

InChI=1S/C26H31N3O2S/c1-18-10-13-28(14-11-18)25(21-6-8-22(32-3)9-7-21)24-23(30)15-19(2)29(26(24)31)17-20-5-4-12-27-16-20/h4-9,12,15-16,18,25,31H,10-11,13-14,17H2,1-3H3