1-(4-chlorophenyl)-5-[(3-ethoxy-4-oxidanyl-5-prop-2-enyl-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(4-chlorophenyl)-5-[(3-ethoxy-4-oxidanyl-5-prop-2-enyl-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-allyl-5-ethoxy-4-hydroxy-phenyl)methylene]-1-(4-chlorophenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(4-chlorophenyl)-5-[(3-ethoxy-4-hydroxy-5-prop-2-enylphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(4-chlorophenyl)-5-[(3-ethoxy-4-hydroxy-5-prop-2-enylphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3-allyl-5-ethoxy-4-hydroxy-benzylidene)-1-(4-chlorophenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H19ClN2O4S MolecularWeight: 442.91526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1O)CC=C)C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=CC(=CC(=C1O)CC=C)C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H19ClN2O4S/c1-3-5-14-10-13(12-18(19(14)26)29-4-2)11-17-20(27)24-22(30)25(21(17)28)16-8-6-15(23)7-9-16/h3,6-12,26H,1,4-5H2,2H3,(H,24,27,30)