4-[2-azanyl-4-(3,4-dimethoxyphenyl)-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[2-azanyl-4-(3,4-dimethoxyphenyl)-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-amino-4-(3,4-dimethoxyphenyl)-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[2-amino-4-(3,4-dimethoxyphenyl)-1H-pyrimidin-6-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2-amino-4-(3,4-dimethoxyphenyl)-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[2-amino-4-(3,4-dimethoxyphenyl)-1H-pyrimidin-6-ylidene]cyclohexa-2,5-dien-1-one Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=C3C=CC(=O)C=C3)NC(=N2)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=C3C=CC(=O)C=C3)NC(=N2)N)OC

InChI

InChI=1S/C18H17N3O3/c1-23-16-8-5-12(9-17(16)24-2)15-10-14(20-18(19)21-15)11-3-6-13(22)7-4-11/h3-10H,1-2H3,(H3,19,20,21)