5-[(1E)-buta-1,3-dienyl]-3-(4-methylphenyl)-2-phenyl-6-piperidin-1-yl-pyrimidin-4-one

Systemtic Name: 5-[(1E)-buta-1,3-dienyl]-3-(4-methylphenyl)-2-phenyl-6-piperidin-1-yl-pyrimidin-4-one Openeye Name: 5-[(1E)-buta-1,3-dienyl]-2-phenyl-6-(1-piperidyl)-3-(p-tolyl)pyrimidin-4-one CAS Name: 5-[(1E)-buta-1,3-dienyl]-3-(4-methylphenyl)-2-phenyl-6-(1-piperidinyl)-4-pyrimidinone IUPAC Name: 5-[(1E)-buta-1,3-dienyl]-3-(4-methylphenyl)-2-phenyl-6-piperidin-1-ylpyrimidin-4-one Traditional Name: 5-[(1E)-buta-1,3-dienyl]-2-phenyl-6-piperidino-3-(p-tolyl)pyrimidin-4-one Formula: C26H27N3O MolecularWeight: 397.51208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NC(=C(C2=O)C=CC=C)N3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NC(=C(C2=O)/C=C/C=C)N3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O/c1-3-4-13-23-25(28-18-9-6-10-19-28)27-24(21-11-7-5-8-12-21)29(26(23)30)22-16-14-20(2)15-17-22/h3-5,7-8,11-17H,1,6,9-10,18-19H2,2H3/b13-4+