(6Z)-6-(2-azanyl-4-methylsulfanyl-1H-pyrimidin-6-ylidene)-4-(2-fluoranyl-4-methyl-phenyl)carbonyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-(2-azanyl-4-methylsulfanyl-1H-pyrimidin-6-ylidene)-4-(2-fluoranyl-4-methyl-phenyl)carbonyl-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-(2-amino-4-methylsulfanyl-1H-pyrimidin-6-ylidene)-4-(2-fluoro-4-methyl-benzoyl)cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[2-amino-4-(methylthio)-1H-pyrimidin-6-ylidene]-4-[(2-fluoro-4-methylphenyl)-oxomethyl]-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-(2-amino-4-methylsulfanyl-1H-pyrimidin-6-ylidene)-4-(2-fluoro-4-methylbenzoyl)cyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[2-amino-4-(methylthio)-1H-pyrimidin-6-ylidene]-4-(2-fluoro-4-methyl-benzoyl)cyclohexa-2,4-dien-1-one Formula: C19H16FN3O2S MolecularWeight: 369.412643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)C2=CC(=C3C=C(N=C(N3)N)SC)C(=O)C=C2)F

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)C2=C/C(=C/3\C=C(N=C(N3)N)SC)/C(=O)C=C2)F

InChI

InChI=1S/C19H16FN3O2S/c1-10-3-5-12(14(20)7-10)18(25)11-4-6-16(24)13(8-11)15-9-17(26-2)23-19(21)22-15/h3-9H,1-2H3,(H3,21,22,23)/b15-13-