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

Systemtic Name: 1-(2-methylphenyl)-5-[(morpholin-4-ylamino)methylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(morpholinoamino)methylene]-1-(o-tolyl)-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(2-methylphenyl)-5-[(4-morpholinylamino)methylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(2-methylphenyl)-5-[(morpholin-4-ylamino)methylidene]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[(morpholinoamino)methylene]-1-(o-tolyl)-3-phenyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C22H22N4O3S MolecularWeight: 422.50008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=CNN3CCOCC3)C(=O)N(C2=S)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C(=CNN3CCOCC3)C(=O)N(C2=S)C4=CC=CC=C4

InChI

InChI=1S/C22H22N4O3S/c1-16-7-5-6-10-19(16)26-21(28)18(15-23-24-11-13-29-14-12-24)20(27)25(22(26)30)17-8-3-2-4-9-17/h2-10,15,23H,11-14H2,1H3