5-[[2-(5-bromanyl-2-methyl-1H-indol-3-yl)ethylamino]-(4-chlorophenyl)methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[2-(5-bromanyl-2-methyl-1H-indol-3-yl)ethylamino]-(4-chlorophenyl)methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[2-(5-bromo-2-methyl-1H-indol-3-yl)ethylamino]-(4-chlorophenyl)methylene]-1-(p-tolyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[2-(5-bromo-2-methyl-1H-indol-3-yl)ethylamino]-(4-chlorophenyl)methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[2-(5-bromo-2-methyl-1H-indol-3-yl)ethylamino]-(4-chlorophenyl)methylidene]-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[2-(5-bromo-2-methyl-1H-indol-3-yl)ethylamino]-(4-chlorophenyl)methylene]-1-(p-tolyl)barbituric acid Formula: C29H24BrClN4O3 MolecularWeight: 591.88286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C(=C(C3=CC=C(C=C3)Cl)NCCC4=C(NC5=C4C=C(C=C5)Br)C)C(=O)NC2=O

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C(=C(C3=CC=C(C=C3)Cl)NCCC4=C(NC5=C4C=C(C=C5)Br)C)C(=O)NC2=O

InChI

InChI=1S/C29H24BrClN4O3/c1-16-3-10-21(11-4-16)35-28(37)25(27(36)34-29(35)38)26(18-5-8-20(31)9-6-18)32-14-13-22-17(2)33-24-12-7-19(30)15-23(22)24/h3-12,15,32-33H,13-14H2,1-2H3,(H,34,36,38)