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

Systemtic Name: 5-[(3-chloranyl-4-ethoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-chloro-4-ethoxy-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3-chloro-4-ethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3-chloro-4-ethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3-chloro-4-ethoxy-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H11ClN2O3S MolecularWeight: 310.75604

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=C2C(=O)NC(=S)NC2=O)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C=C2C(=O)NC(=S)NC2=O)Cl

InChI

InChI=1S/C13H11ClN2O3S/c1-2-19-10-4-3-7(6-9(10)14)5-8-11(17)15-13(20)16-12(8)18/h3-6H,2H2,1H3,(H2,15,16,17,18,20)