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

Systemtic Name: 4-[[4-chloranyl-6-(4-methylpiperidin-1-yl)pyrimidin-2-yl]sulfanylmethyl]-N-(diphenylmethyl)benzamide Openeye Name: N-benzhydryl-4-[[4-chloro-6-(4-methyl-1-piperidyl)pyrimidin-2-yl]sulfanylmethyl]benzamide CAS Name: 4-[[[4-chloro-6-(4-methyl-1-piperidinyl)-2-pyrimidinyl]thio]methyl]-N-(diphenylmethyl)benzamide IUPAC Name: N-benzhydryl-4-[[4-chloro-6-(4-methylpiperidin-1-yl)pyrimidin-2-yl]sulfanylmethyl]benzamide Traditional Name: N-benzhydryl-4-[[[4-chloro-6-(4-methylpiperidino)pyrimidin-2-yl]thio]methyl]benzamide Formula: C31H31ClN4OS MolecularWeight: 543.12204

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC(=NC(=N2)SCC3=CC=C(C=C3)C(=O)NC(C4=CC=CC=C4)C5=CC=CC=C5)Cl

Isomeric SMILES

CC1CCN(CC1)C2=CC(=NC(=N2)SCC3=CC=C(C=C3)C(=O)NC(C4=CC=CC=C4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C31H31ClN4OS/c1-22-16-18-36(19-17-22)28-20-27(32)33-31(34-28)38-21-23-12-14-26(15-13-23)30(37)35-29(24-8-4-2-5-9-24)25-10-6-3-7-11-25/h2-15,20,22,29H,16-19,21H2,1H3,(H,35,37)