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

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-(1,3-benzodioxol-5-ylmethylene)-1,3-dimethyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-(1,3-benzodioxol-5-ylmethylidene)-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1,3-dimethyl-5-piperonylidene-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C14H12N2O4S MolecularWeight: 304.32108

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC3=C(C=C2)OCO3)C(=O)N(C1=S)C

Isomeric SMILES

CN1C(=O)C(=CC2=CC3=C(C=C2)OCO3)C(=O)N(C1=S)C

InChI

InChI=1S/C14H12N2O4S/c1-15-12(17)9(13(18)16(2)14(15)21)5-8-3-4-10-11(6-8)20-7-19-10/h3-6H,7H2,1-2H3