(6E)-6-[2-azanyl-6-[1-(2-oxidanyl-2-phenyl-ethyl)piperidin-4-yl]-1H-pyrimidin-4-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[2-azanyl-6-[1-(2-oxidanyl-2-phenyl-ethyl)piperidin-4-yl]-1H-pyrimidin-4-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[2-amino-6-[1-(2-hydroxy-2-phenyl-ethyl)-4-piperidyl]-1H-pyrimidin-4-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[2-amino-6-[1-(2-hydroxy-2-phenylethyl)-4-piperidinyl]-1H-pyrimidin-4-ylidene]-4-methyl-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[2-amino-6-[1-(2-hydroxy-2-phenylethyl)piperidin-4-yl]-1H-pyrimidin-4-ylidene]-4-methylcyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[2-amino-6-[1-(2-hydroxy-2-phenyl-ethyl)-4-piperidyl]-1H-pyrimidin-4-ylidene]-4-methyl-cyclohexa-2,4-dien-1-one Formula: C24H28N4O2 MolecularWeight: 404.50472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(NC(=N2)N)C3CCN(CC3)CC(C4=CC=CC=C4)O)C(=O)C=C1

Isomeric SMILES

CC1=C/C(=C\2/C=C(NC(=N2)N)C3CCN(CC3)CC(C4=CC=CC=C4)O)/C(=O)C=C1

InChI

InChI=1S/C24H28N4O2/c1-16-7-8-22(29)19(13-16)21-14-20(26-24(25)27-21)17-9-11-28(12-10-17)15-23(30)18-5-3-2-4-6-18/h2-8,13-14,17,23,30H,9-12,15H2,1H3,(H3,25,26,27)/b21-19+