(5E)-5-[[1-(4-bromophenyl)pyrrol-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-5-[[1-(4-bromophenyl)pyrrol-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-5-[[1-(4-bromophenyl)pyrrol-2-yl]methylene]-1-methyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-5-[[1-(4-bromophenyl)-2-pyrrolyl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-5-[[1-(4-bromophenyl)pyrrol-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-5-[[1-(4-bromophenyl)pyrrol-2-yl]methylene]-1-methyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H12BrN3O2S MolecularWeight: 390.25438

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC=CN2C3=CC=C(C=C3)Br)C(=O)NC1=S

Isomeric SMILES

CN1C(=O)/C(=C/C2=CC=CN2C3=CC=C(C=C3)Br)/C(=O)NC1=S

InChI

InChI=1S/C16H12BrN3O2S/c1-19-15(22)13(14(21)18-16(19)23)9-12-3-2-8-20(12)11-6-4-10(17)5-7-11/h2-9H,1H3,(H,18,21,23)/b13-9+