(5E)-5-[[5-(2-bromanyl-4-methyl-phenyl)furan-2-yl]methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: (5E)-5-[[5-(2-bromanyl-4-methyl-phenyl)furan-2-yl]methylidene]-6-oxidanylidene-2-sulfanylidene-pyrimidin-4-olate Openeye Name: (5E)-5-[[5-(2-bromo-4-methyl-phenyl)-2-furyl]methylene]-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: (5E)-5-[[5-(2-bromo-4-methylphenyl)-2-furanyl]methylidene]-6-oxo-2-sulfanylidene-4-pyrimidinolate IUPAC Name: (5E)-5-[[5-(2-bromo-4-methylphenyl)furan-2-yl]methylidene]-6-oxo-2-sulfanylidenepyrimidin-4-olate Traditional Name: (5E)-5-[[5-(2-bromo-4-methyl-phenyl)-2-furyl]methylene]-6-keto-2-thioxo-pyrimidin-4-olate Formula: C16H10BrN2O3S- MolecularWeight: 390.2312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC=C(O2)C=C3C(=O)NC(=S)N=C3[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC=C(O2)/C=C\3/C(=O)NC(=S)N=C3[O-])Br

InChI

InChI=1S/C16H11BrN2O3S/c1-8-2-4-10(12(17)6-8)13-5-3-9(22-13)7-11-14(20)18-16(23)19-15(11)21/h2-7H,1H3,(H2,18,19,20,21,23)/p-1