5-[[1-(4-methylphenyl)-2,5-diphenyl-pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[1-(4-methylphenyl)-2,5-diphenyl-pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[2,5-diphenyl-1-(p-tolyl)pyrrol-3-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[1-(4-methylphenyl)-2,5-diphenyl-3-pyrrolyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[1-(4-methylphenyl)-2,5-diphenylpyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[2,5-diphenyl-1-(p-tolyl)pyrrol-3-yl]methylene]barbituric acid Formula: C28H21N3O3 MolecularWeight: 447.48464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C3=CC=CC=C3)C=C4C(=O)NC(=O)NC4=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C3=CC=CC=C3)C=C4C(=O)NC(=O)NC4=O)C5=CC=CC=C5

InChI

InChI=1S/C28H21N3O3/c1-18-12-14-22(15-13-18)31-24(19-8-4-2-5-9-19)17-21(25(31)20-10-6-3-7-11-20)16-23-26(32)29-28(34)30-27(23)33/h2-17H,1H3,(H2,29,30,32,33,34)