3-[(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]-N-(diphenylmethyl)benzamide

Systemtic Name: 3-[(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanylmethyl]-N-(diphenylmethyl)benzamide Openeye Name: N-benzhydryl-3-[[4-chloro-6-(1-piperidyl)pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: 3-[[[4-chloro-6-(1-piperidinyl)-2-pyrimidinyl]thio]methyl]-N-(diphenylmethyl)benzamide IUPAC Name: N-benzhydryl-3-[(4-chloro-6-piperidin-1-ylpyrimidin-2-yl)sulfanylmethyl]benzamide Traditional Name: N-benzhydryl-3-[[(4-chloro-6-piperidino-pyrimidin-2-yl)thio]methyl]benzamide Formula: C30H29ClN4OS MolecularWeight: 529.09546

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC(=N2)SCC3=CC=CC(=C3)C(=O)NC(C4=CC=CC=C4)C5=CC=CC=C5)Cl

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC(=N2)SCC3=CC=CC(=C3)C(=O)NC(C4=CC=CC=C4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C30H29ClN4OS/c31-26-20-27(35-17-8-3-9-18-35)33-30(32-26)37-21-22-11-10-16-25(19-22)29(36)34-28(23-12-4-1-5-13-23)24-14-6-2-7-15-24/h1-2,4-7,10-16,19-20,28H,3,8-9,17-18,21H2,(H,34,36)