(6E)-6-(2-azanyl-6-piperidin-3-yl-1H-pyrimidin-4-ylidene)-5-[(4-methylphenyl)methoxy]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-(2-azanyl-6-piperidin-3-yl-1H-pyrimidin-4-ylidene)-5-[(4-methylphenyl)methoxy]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[2-amino-6-(3-piperidyl)-1H-pyrimidin-4-ylidene]-5-(p-tolylmethoxy)cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[2-amino-6-(3-piperidinyl)-1H-pyrimidin-4-ylidene]-5-[(4-methylphenyl)methoxy]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-(2-amino-6-piperidin-3-yl-1H-pyrimidin-4-ylidene)-5-[(4-methylphenyl)methoxy]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[2-amino-6-(3-piperidyl)-1H-pyrimidin-4-ylidene]-5-(4-methylbenzyl)oxy-cyclohexa-2,4-dien-1-one Formula: C23H26N4O2 MolecularWeight: 390.47814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=CC=CC(=O)C2=C3C=C(NC(=N3)N)C4CCCNC4

Isomeric SMILES

CC1=CC=C(C=C1)COC\2=CC=CC(=O)/C2=C/3\C=C(NC(=N3)N)C4CCCNC4

InChI

InChI=1S/C23H26N4O2/c1-15-7-9-16(10-8-15)14-29-21-6-2-5-20(28)22(21)19-12-18(26-23(24)27-19)17-4-3-11-25-13-17/h2,5-10,12,17,25H,3-4,11,13-14H2,1H3,(H3,24,26,27)/b22-19-