4-(5-methylsulfonyl-6-phenyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(5-methylsulfonyl-6-phenyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(5-methylsulfonyl-6-phenyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-(5-methylsulfonyl-6-phenyl-1H-pyrimidin-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: 4-(5-methylsulfonyl-6-phenyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-(5-mesyl-6-phenyl-1H-pyrimidin-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(NC(=C2C=CC(=O)C=C2)N=C1)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=C(NC(=C2C=CC(=O)C=C2)N=C1)C3=CC=CC=C3

InChI

InChI=1S/C17H14N2O3S/c1-23(21,22)15-11-18-17(13-7-9-14(20)10-8-13)19-16(15)12-5-3-2-4-6-12/h2-11,19H,1H3