5-[(2,5-dimethyl-1-quinolin-7-yl-pyrrol-3-yl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(2,5-dimethyl-1-quinolin-7-yl-pyrrol-3-yl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[2,5-dimethyl-1-(7-quinolyl)pyrrol-3-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[2,5-dimethyl-1-(7-quinolinyl)-3-pyrrolyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(2,5-dimethyl-1-quinolin-7-ylpyrrol-3-yl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[2,5-dimethyl-1-(7-quinolyl)pyrrol-3-yl]methylene]barbituric acid Formula: C20H16N4O3 MolecularWeight: 360.36604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=CC=N3)C=C2)C)C=C4C(=O)NC(=O)NC4=O

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=CC=N3)C=C2)C)C=C4C(=O)NC(=O)NC4=O

InChI

InChI=1S/C20H16N4O3/c1-11-8-14(9-16-18(25)22-20(27)23-19(16)26)12(2)24(11)15-6-5-13-4-3-7-21-17(13)10-15/h3-10H,1-2H3,(H2,22,23,25,26,27)