5-[[3,5-bis(chloranyl)-4-ethoxy-phenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[3,5-bis(chloranyl)-4-ethoxy-phenyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3,5-dichloro-4-ethoxy-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3,5-dichloro-4-ethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3,5-dichloro-4-ethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3,5-dichloro-4-ethoxy-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H10Cl2N2O3S MolecularWeight: 345.2011

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C=C2C(=O)NC(=S)NC2=O)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C=C2C(=O)NC(=S)NC2=O)Cl

InChI

InChI=1S/C13H10Cl2N2O3S/c1-2-20-10-8(14)4-6(5-9(10)15)3-7-11(18)16-13(21)17-12(7)19/h3-5H,2H2,1H3,(H2,16,17,18,19,21)