4-[(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]-N-[1-(phenylmethyl)piperidin-4-yl]benzamide

Systemtic Name: 4-[(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]-N-[1-(phenylmethyl)piperidin-4-yl]benzamide Openeye Name: N-(1-benzyl-4-piperidyl)-4-[[4-chloro-6-(1-piperidyl)pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: 4-[[[4-chloro-6-(1-piperidinyl)-2-pyrimidinyl]thio]methyl]-N-[1-(phenylmethyl)-4-piperidinyl]benzamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-4-[(4-chloro-6-piperidin-1-ylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-(1-benzyl-4-piperidyl)-4-[[(4-chloro-6-piperidino-pyrimidin-2-yl)thio]methyl]benzamide Formula: C29H34ClN5OS MolecularWeight: 536.13116

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC(=N2)SCC3=CC=C(C=C3)C(=O)NC4CCN(CC4)CC5=CC=CC=C5)Cl

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC(=N2)SCC3=CC=C(C=C3)C(=O)NC4CCN(CC4)CC5=CC=CC=C5)Cl

InChI

InChI=1S/C29H34ClN5OS/c30-26-19-27(35-15-5-2-6-16-35)33-29(32-26)37-21-23-9-11-24(12-10-23)28(36)31-25-13-17-34(18-14-25)20-22-7-3-1-4-8-22/h1,3-4,7-12,19,25H,2,5-6,13-18,20-21H2,(H,31,36)