(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-1-(4-bromophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-1-(4-bromophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5Z)-5-(1,3-benzodioxol-5-ylmethylene)-1-(4-bromophenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-1-(4-bromophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-1-(4-bromophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5Z)-1-(4-bromophenyl)-5-piperonylidene-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H11BrN2O4S MolecularWeight: 431.25994

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C\3/C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C18H11BrN2O4S/c19-11-2-4-12(5-3-11)21-17(23)13(16(22)20-18(21)26)7-10-1-6-14-15(8-10)25-9-24-14/h1-8H,9H2,(H,20,22,26)/b13-7-