1-(2,3-dimethylphenyl)-5-[(4-ethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(2,3-dimethylphenyl)-5-[(4-ethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(2,3-dimethylphenyl)-5-[(4-ethoxyphenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(2,3-dimethylphenyl)-5-[(4-ethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(2,3-dimethylphenyl)-5-[(4-ethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(2,3-dimethylphenyl)-5-(4-ethoxybenzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=CC(=C3C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=CC(=C3C)C

InChI

InChI=1S/C21H20N2O3S/c1-4-26-16-10-8-15(9-11-16)12-17-19(24)22-21(27)23(20(17)25)18-7-5-6-13(2)14(18)3/h5-12H,4H2,1-3H3,(H,22,24,27)