6-[4-(4-bromophenyl)-2-(3,5-dimethylpyrazol-1-yl)-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-(4-bromophenyl)-2-(3,5-dimethylpyrazol-1-yl)-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(4-bromophenyl)-2-(3,5-dimethylpyrazol-1-yl)-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(4-bromophenyl)-2-(3,5-dimethyl-1-pyrazolyl)-1H-pyrimidin-6-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(4-bromophenyl)-2-(3,5-dimethylpyrazol-1-yl)-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(4-bromophenyl)-2-(3,5-dimethylpyrazol-1-yl)-1H-pyrimidin-6-ylidene]cyclohexa-2,4-dien-1-one Formula: C21H17BrN4O MolecularWeight: 421.28988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC(=CC(=C3C=CC=CC3=O)N2)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC(=NN1C2=NC(=CC(=C3C=CC=CC3=O)N2)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C21H17BrN4O/c1-13-11-14(2)26(25-13)21-23-18(15-7-9-16(22)10-8-15)12-19(24-21)17-5-3-4-6-20(17)27/h3-12H,1-2H3,(H,23,24)