5-[1,3-benzodioxol-5-yl-(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[1,3-benzodioxol-5-yl-(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[1,3-benzodioxol-5-yl-(2,5-dimethyl-1H-pyrrol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[1,3-benzodioxol-5-yl-(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[1,3-benzodioxol-5-yl-(2,5-dimethyl-1H-pyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[1,3-benzodioxol-5-yl-(2,5-dimethyl-1H-pyrrol-3-yl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H15N3O4S MolecularWeight: 369.3944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C)C(=C2C(=O)NC(=S)NC2=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(N1)C)C(=C2C(=O)NC(=S)NC2=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H15N3O4S/c1-8-5-11(9(2)19-8)14(15-16(22)20-18(26)21-17(15)23)10-3-4-12-13(6-10)25-7-24-12/h3-6,19H,7H2,1-2H3,(H2,20,21,22,23,26)