1-(4-ethylphenyl)-5-[[(2-methylsulfanylphenyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(4-ethylphenyl)-5-[[(2-methylsulfanylphenyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(4-ethylphenyl)-5-[(2-methylsulfanylanilino)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(4-ethylphenyl)-5-[[2-(methylthio)anilino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(4-ethylphenyl)-5-[(2-methylsulfanylanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(4-ethylphenyl)-5-[[2-(methylthio)anilino]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C20H19N3O2S2 MolecularWeight: 397.51376

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC=CC=C3SC)C(=O)NC2=S

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC=CC=C3SC)C(=O)NC2=S

InChI

InChI=1S/C20H19N3O2S2/c1-3-13-8-10-14(11-9-13)23-19(25)15(18(24)22-20(23)26)12-21-16-6-4-5-7-17(16)27-2/h4-12,21H,3H2,1-2H3,(H,22,24,26)