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

Systemtic Name: 5-[[(4-methoxyphenyl)amino]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(4-methoxyanilino)methylene]-1-methyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(4-methoxyanilino)methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(4-methoxyanilino)methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-methyl-5-(p-anisidinomethylene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C13H13N3O3S MolecularWeight: 291.32562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CNC2=CC=C(C=C2)OC)C(=O)NC1=S

Isomeric SMILES

CN1C(=O)C(=CNC2=CC=C(C=C2)OC)C(=O)NC1=S

InChI

InChI=1S/C13H13N3O3S/c1-16-12(18)10(11(17)15-13(16)20)7-14-8-3-5-9(19-2)6-4-8/h3-7,14H,1-2H3,(H,15,17,20)