N-[(1-ethylpyrrolidin-2-yl)methyl]-6-(4-methylsulfanylphenyl)-2-(4-oxidanylpiperidin-1-yl)pyridine-3-carboxamide

Systemtic Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-6-(4-methylsulfanylphenyl)-2-(4-oxidanylpiperidin-1-yl)pyridine-3-carboxamide Openeye Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(4-hydroxy-1-piperidyl)-6-(4-methylsulfanylphenyl)pyridine-3-carboxamide CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-2-(4-hydroxy-1-piperidinyl)-6-[4-(methylthio)phenyl]-3-pyridinecarboxamide IUPAC Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(4-hydroxypiperidin-1-yl)-6-(4-methylsulfanylphenyl)pyridine-3-carboxamide Traditional Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-(4-hydroxypiperidino)-6-[4-(methylthio)phenyl]nicotinamide Formula: C25H34N4O2S MolecularWeight: 454.62806

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=O)C2=C(N=C(C=C2)C3=CC=C(C=C3)SC)N4CCC(CC4)O

Isomeric SMILES

CCN1CCCC1CNC(=O)C2=C(N=C(C=C2)C3=CC=C(C=C3)SC)N4CCC(CC4)O

InChI

InChI=1S/C25H34N4O2S/c1-3-28-14-4-5-19(28)17-26-25(31)22-10-11-23(18-6-8-21(32-2)9-7-18)27-24(22)29-15-12-20(30)13-16-29/h6-11,19-20,30H,3-5,12-17H2,1-2H3,(H,26,31)