4-[6-(4-methylphenyl)-2-piperidin-1-yl-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[6-(4-methylphenyl)-2-piperidin-1-yl-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-(1-piperidyl)-6-(p-tolyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[6-(4-methylphenyl)-2-(1-piperidinyl)-1H-pyrimidin-4-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[6-(4-methylphenyl)-2-piperidin-1-yl-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[2-piperidino-6-(p-tolyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one Formula: C22H23N3O MolecularWeight: 345.43752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C3C=CC(=O)C=C3)N=C(N2)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C3C=CC(=O)C=C3)N=C(N2)N4CCCCC4

InChI

InChI=1S/C22H23N3O/c1-16-5-7-17(8-6-16)20-15-21(18-9-11-19(26)12-10-18)24-22(23-20)25-13-3-2-4-14-25/h5-12,15H,2-4,13-14H2,1H3,(H,23,24)