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

Systemtic Name: 5-[(3-chloranyl-4-ethoxy-5-methoxy-phenyl)methylidene]-1-(2,3-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-chloro-4-ethoxy-5-methoxy-phenyl)methylene]-1-(2,3-dimethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3-chloro-4-ethoxy-5-methoxyphenyl)methylidene]-1-(2,3-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3-chloro-4-ethoxy-5-methoxyphenyl)methylidene]-1-(2,3-dimethylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(3-chloro-4-ethoxy-5-methoxy-benzylidene)-1-(2,3-dimethylphenyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H21ClN2O4S MolecularWeight: 444.93114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C=C2C(=O)NC(=S)N(C2=O)C3=CC=CC(=C3C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C=C2C(=O)NC(=S)N(C2=O)C3=CC=CC(=C3C)C)OC

InChI

InChI=1S/C22H21ClN2O4S/c1-5-29-19-16(23)10-14(11-18(19)28-4)9-15-20(26)24-22(30)25(21(15)27)17-8-6-7-12(2)13(17)3/h6-11H,5H2,1-4H3,(H,24,26,30)