(6Z)-3-ethoxy-6-[4-(octylamino)-2-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-3-ethoxy-6-[4-(octylamino)-2-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-3-ethoxy-6-[4-(octylamino)-2-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6Z)-3-ethoxy-6-[4-(octylamino)-2-phenyl-1H-pyrimidin-6-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-3-ethoxy-6-[4-(octylamino)-2-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-3-ethoxy-6-[4-(octylamino)-2-phenyl-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=CC(=C2C=CC(=CC2=O)OCC)NC(=N1)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCNC1=C/C(=C/2\C=CC(=CC2=O)OCC)/NC(=N1)C3=CC=CC=C3

InChI

InChI=1S/C26H33N3O2/c1-3-5-6-7-8-12-17-27-25-19-23(22-16-15-21(31-4-2)18-24(22)30)28-26(29-25)20-13-10-9-11-14-20/h9-11,13-16,18-19,27H,3-8,12,17H2,1-2H3,(H,28,29)/b23-22-