2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[1-(phenylmethyl)piperidin-4-yl]ethanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-[1-(phenylmethyl)piperidin-4-yl]ethanamide Openeye Name: N-(1-benzyl-4-piperidyl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-[1-(phenylmethyl)-4-piperidinyl]acetamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(1-benzyl-4-piperidyl)-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C20H26N4OS MolecularWeight: 370.51164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2CCN(CC2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2CCN(CC2)CC3=CC=CC=C3)C

InChI

InChI=1S/C20H26N4OS/c1-15-12-16(2)22-20(21-15)26-14-19(25)23-18-8-10-24(11-9-18)13-17-6-4-3-5-7-17/h3-7,12,18H,8-11,13-14H2,1-2H3,(H,23,25)