2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-[1-(phenylmethyl)piperidin-4-yl]ethanamide

Systemtic Name: 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-N-[1-(phenylmethyl)piperidin-4-yl]ethanamide Openeye Name: N-(1-benzyl-4-piperidyl)-2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]acetamide CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-N-[1-(phenylmethyl)-4-piperidinyl]acetamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylacetamide Traditional Name: N-(1-benzyl-4-piperidyl)-2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]acetamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C#N)SCC(=O)NC2CCN(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=C1C#N)SCC(=O)NC2CCN(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H26N4OS/c1-16-12-17(2)24-22(20(16)13-23)28-15-21(27)25-19-8-10-26(11-9-19)14-18-6-4-3-5-7-18/h3-7,12,19H,8-11,14-15H2,1-2H3,(H,25,27)