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

Systemtic Name: 6-[2-azanyl-5-phenyl-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]-3-[(4-methylphenyl)methoxy]cyclohexa-2,4-dien-1-one Openeye Name: 6-[2-amino-5-phenyl-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]-3-(p-tolylmethoxy)cyclohexa-2,4-dien-1-one CAS Name: 6-[2-amino-5-phenyl-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]-3-[(4-methylphenyl)methoxy]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[2-amino-5-phenyl-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]-3-[(4-methylphenyl)methoxy]cyclohexa-2,4-dien-1-one Traditional Name: 6-[2-amino-5-phenyl-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]-3-(4-methylbenzyl)oxy-cyclohexa-2,4-dien-1-one Formula: C25H20F3N3O2 MolecularWeight: 451.44041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC2=CC(=O)C(=C3C(=C(NC(=N3)N)C(F)(F)F)C4=CC=CC=C4)C=C2

Isomeric SMILES

CC1=CC=C(C=C1)COC2=CC(=O)C(=C3C(=C(NC(=N3)N)C(F)(F)F)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C25H20F3N3O2/c1-15-7-9-16(10-8-15)14-33-18-11-12-19(20(32)13-18)22-21(17-5-3-2-4-6-17)23(25(26,27)28)31-24(29)30-22/h2-13H,14H2,1H3,(H3,29,30,31)