methyl (Z)-3-(3-bromanyl-4-fluoranyl-phenyl)-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate

Systemtic Name: methyl (Z)-3-(3-bromanyl-4-fluoranyl-phenyl)-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate Openeye Name: methyl (Z)-3-(3-bromo-4-fluoro-phenyl)-2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)prop-2-enoate CAS Name: (Z)-3-(3-bromo-4-fluorophenyl)-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-(3-bromo-4-fluorophenyl)-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate Traditional Name: (Z)-3-(3-bromo-4-fluoro-phenyl)-2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)acrylic acid methyl ester Formula: C14H10BrFN2O3S MolecularWeight: 385.208203

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=CC1=CC(=C(C=C1)F)Br)C2=CC(=O)NC(=S)N2

Isomeric SMILES

COC(=O)/C(=C\C1=CC(=C(C=C1)F)Br)/C2=CC(=O)NC(=S)N2

InChI

InChI=1S/C14H10BrFN2O3S/c1-21-13(20)8(11-6-12(19)18-14(22)17-11)4-7-2-3-10(16)9(15)5-7/h2-6H,1H3,(H2,17,18,19,22)/b8-4-