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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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