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

Systemtic Name: 5-[[(3,4-dimethylphenyl)amino]methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3,4-dimethylanilino)methylene]-1-(4-ethoxyphenyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(3,4-dimethylanilino)methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(3,4-dimethylanilino)methylidene]-1-(4-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(3,4-dimethylanilino)methylene]-1-p-phenetyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C21H21N3O3S MolecularWeight: 395.47474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC(=C(C=C3)C)C)C(=O)NC2=S

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C(=CNC3=CC(=C(C=C3)C)C)C(=O)NC2=S

InChI

InChI=1S/C21H21N3O3S/c1-4-27-17-9-7-16(8-10-17)24-20(26)18(19(25)23-21(24)28)12-22-15-6-5-13(2)14(3)11-15/h5-12,22H,4H2,1-3H3,(H,23,25,28)