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

Systemtic Name: 4-[6-(2-chlorophenyl)-5-pyrimidin-4-yl-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[6-(2-chlorophenyl)-5-pyrimidin-4-yl-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[6-(2-chlorophenyl)-5-(4-pyrimidinyl)-1H-pyrimidin-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[6-(2-chlorophenyl)-5-pyrimidin-4-yl-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[6-(2-chlorophenyl)-5-(4-pyrimidyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C20H13ClN4O MolecularWeight: 360.79642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(C=NC(=C3C=CC(=O)C=C3)N2)C4=NC=NC=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(C=NC(=C3C=CC(=O)C=C3)N2)C4=NC=NC=C4)Cl

InChI

InChI=1S/C20H13ClN4O/c21-17-4-2-1-3-15(17)19-16(18-9-10-22-12-24-18)11-23-20(25-19)13-5-7-14(26)8-6-13/h1-12,25H