6-[2-azanyl-5-(3-methoxyphenoxy)-6-methyl-1H-pyrimidin-4-ylidene]-3-[(2,5-dimethylphenyl)methoxy]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[2-azanyl-5-(3-methoxyphenoxy)-6-methyl-1H-pyrimidin-4-ylidene]-3-[(2,5-dimethylphenyl)methoxy]cyclohexa-2,4-dien-1-one Openeye Name: 6-[2-amino-5-(3-methoxyphenoxy)-6-methyl-1H-pyrimidin-4-ylidene]-3-[(2,5-dimethylphenyl)methoxy]cyclohexa-2,4-dien-1-one CAS Name: 6-[2-amino-5-(3-methoxyphenoxy)-6-methyl-1H-pyrimidin-4-ylidene]-3-[(2,5-dimethylphenyl)methoxy]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[2-amino-5-(3-methoxyphenoxy)-6-methyl-1H-pyrimidin-4-ylidene]-3-[(2,5-dimethylphenyl)methoxy]cyclohexa-2,4-dien-1-one Traditional Name: 6-[2-amino-5-(3-methoxyphenoxy)-6-methyl-1H-pyrimidin-4-ylidene]-3-(2,5-dimethylbenzyl)oxy-cyclohexa-2,4-dien-1-one Formula: C27H27N3O4 MolecularWeight: 457.52098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC2=CC(=O)C(=C3C(=C(NC(=N3)N)C)OC4=CC(=CC=C4)OC)C=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC2=CC(=O)C(=C3C(=C(NC(=N3)N)C)OC4=CC(=CC=C4)OC)C=C2

InChI

InChI=1S/C27H27N3O4/c1-16-8-9-17(2)19(12-16)15-33-21-10-11-23(24(31)14-21)25-26(18(3)29-27(28)30-25)34-22-7-5-6-20(13-22)32-4/h5-14H,15H2,1-4H3,(H3,28,29,30)