2-methylsulfanyl-N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: 2-methylsulfanyl-N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine-3-carboxamide Openeye Name: 2-methylsulfanyl-N-[1-(4-pyridylmethyl)-4-piperidyl]pyridine-3-carboxamide CAS Name: 2-(methylthio)-N-[1-(pyridin-4-ylmethyl)-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: 2-methylsulfanyl-N-[1-(pyridin-4-ylmethyl)piperidin-4-yl]pyridine-3-carboxamide Traditional Name: 2-(methylthio)-N-[1-(4-pyridylmethyl)-4-piperidyl]nicotinamide Formula: C18H22N4OS MolecularWeight: 342.45848

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)NC2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)NC2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C18H22N4OS/c1-24-18-16(3-2-8-20-18)17(23)21-15-6-11-22(12-7-15)13-14-4-9-19-10-5-14/h2-5,8-10,15H,6-7,11-13H2,1H3,(H,21,23)