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

Systemtic Name: 1-cyclohexyl-5-[(2,5-dimethyl-1-pyridin-4-yl-pyrrol-3-yl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-cyclohexyl-5-[[2,5-dimethyl-1-(4-pyridyl)pyrrol-3-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-cyclohexyl-5-[(2,5-dimethyl-1-pyridin-4-yl-3-pyrrolyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-cyclohexyl-5-[(2,5-dimethyl-1-pyridin-4-ylpyrrol-3-yl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-cyclohexyl-5-[[2,5-dimethyl-1-(4-pyridyl)pyrrol-3-yl]methylene]barbituric acid Formula: C22H24N4O3 MolecularWeight: 392.45096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=NC=C2)C)C=C3C(=O)NC(=O)N(C3=O)C4CCCCC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=NC=C2)C)C=C3C(=O)NC(=O)N(C3=O)C4CCCCC4

InChI

InChI=1S/C22H24N4O3/c1-14-12-16(15(2)25(14)18-8-10-23-11-9-18)13-19-20(27)24-22(29)26(21(19)28)17-6-4-3-5-7-17/h8-13,17H,3-7H2,1-2H3,(H,24,27,29)