(5Z)-5-[[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5Z)-5-[[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5Z)-5-[[5-(2-bromo-4-nitro-phenyl)-2-furyl]methylene]-1-methyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5Z)-5-[[5-(2-bromo-4-nitrophenyl)-2-furanyl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5Z)-5-[[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5Z)-5-[[5-(2-bromo-4-nitro-phenyl)-2-furyl]methylene]-1-methyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H10BrN3O5S MolecularWeight: 436.2367

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])Br)C(=O)NC1=S

Isomeric SMILES

CN1C(=O)/C(=C\C2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])Br)/C(=O)NC1=S

InChI

InChI=1S/C16H10BrN3O5S/c1-19-15(22)11(14(21)18-16(19)26)7-9-3-5-13(25-9)10-4-2-8(20(23)24)6-12(10)17/h2-7H,1H3,(H,18,21,26)/b11-7-