(6Z)-6-(2-azanyl-1H-pyrimidin-6-ylidene)-4-(4-chlorophenyl)carbonyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-(2-azanyl-1H-pyrimidin-6-ylidene)-4-(4-chlorophenyl)carbonyl-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-(2-amino-1H-pyrimidin-6-ylidene)-4-(4-chlorobenzoyl)cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-(2-amino-1H-pyrimidin-6-ylidene)-4-[(4-chlorophenyl)-oxomethyl]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-(2-amino-1H-pyrimidin-6-ylidene)-4-(4-chlorobenzoyl)cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-(2-amino-1H-pyrimidin-6-ylidene)-4-(4-chlorobenzoyl)cyclohexa-2,4-dien-1-one Formula: C17H12ClN3O2 MolecularWeight: 325.74908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC(=C3C=CN=C(N3)N)C(=O)C=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=C/C(=C/3\C=CN=C(N3)N)/C(=O)C=C2)Cl

InChI

InChI=1S/C17H12ClN3O2/c18-12-4-1-10(2-5-12)16(23)11-3-6-15(22)13(9-11)14-7-8-20-17(19)21-14/h1-9H,(H3,19,20,21)/b14-13-