1-[6-(4-methylphenyl)-2-[(4-methylphenyl)methylsulfanyl]pyrimidin-4-yl]piperidine-4-carboxamide

Systemtic Name: 1-[6-(4-methylphenyl)-2-[(4-methylphenyl)methylsulfanyl]pyrimidin-4-yl]piperidine-4-carboxamide Openeye Name: 1-[6-(p-tolyl)-2-(p-tolylmethylsulfanyl)pyrimidin-4-yl]piperidine-4-carboxamide CAS Name: 1-[6-(4-methylphenyl)-2-[(4-methylphenyl)methylthio]-4-pyrimidinyl]-4-piperidinecarboxamide IUPAC Name: 1-[6-(4-methylphenyl)-2-[(4-methylphenyl)methylsulfanyl]pyrimidin-4-yl]piperidine-4-carboxamide Traditional Name: 1-[2-[(4-methylbenzyl)thio]-6-(p-tolyl)pyrimidin-4-yl]isonipecotamide Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC(=CC(=N2)N3CCC(CC3)C(=O)N)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC(=CC(=N2)N3CCC(CC3)C(=O)N)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H28N4OS/c1-17-3-7-19(8-4-17)16-31-25-27-22(20-9-5-18(2)6-10-20)15-23(28-25)29-13-11-21(12-14-29)24(26)30/h3-10,15,21H,11-14,16H2,1-2H3,(H2,26,30)