(6E)-6-(2-azanyl-4-phenyl-1H-pyrimidin-6-ylidene)-2-bromanyl-4-methyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-(2-azanyl-4-phenyl-1H-pyrimidin-6-ylidene)-2-bromanyl-4-methyl-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-(2-amino-4-phenyl-1H-pyrimidin-6-ylidene)-2-bromo-4-methyl-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-(2-amino-4-phenyl-1H-pyrimidin-6-ylidene)-2-bromo-4-methyl-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-(2-amino-4-phenyl-1H-pyrimidin-6-ylidene)-2-bromo-4-methylcyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-(2-amino-4-phenyl-1H-pyrimidin-6-ylidene)-2-bromo-4-methyl-cyclohexa-2,4-dien-1-one Formula: C17H14BrN3O MolecularWeight: 356.21656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(N=C(N2)N)C3=CC=CC=C3)C(=O)C(=C1)Br

Isomeric SMILES

CC1=C/C(=C\2/C=C(N=C(N2)N)C3=CC=CC=C3)/C(=O)C(=C1)Br

InChI

InChI=1S/C17H14BrN3O/c1-10-7-12(16(22)13(18)8-10)15-9-14(20-17(19)21-15)11-5-3-2-4-6-11/h2-9H,1H3,(H3,19,20,21)/b15-12+