1-(2-methylphenyl)-5-[(3-morpholin-4-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(2-methylphenyl)-5-[(3-morpholin-4-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-morpholinopropylamino)methylene]-1-(o-tolyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(2-methylphenyl)-5-[[3-(4-morpholinyl)propylamino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(2-methylphenyl)-5-[(3-morpholin-4-ylpropylamino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(3-morpholinopropylamino)methylene]-1-(o-tolyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C19H24N4O3S MolecularWeight: 388.48386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=CNCCCN3CCOCC3)C(=O)NC2=S

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C(=CNCCCN3CCOCC3)C(=O)NC2=S

InChI

InChI=1S/C19H24N4O3S/c1-14-5-2-3-6-16(14)23-18(25)15(17(24)21-19(23)27)13-20-7-4-8-22-9-11-26-12-10-22/h2-3,5-6,13,20H,4,7-12H2,1H3,(H,21,24,27)