5-[[1-phenyl-3-(4-propan-2-yloxyphenyl)pyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[1-phenyl-3-(4-propan-2-yloxyphenyl)pyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[3-(4-isopropoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[1-phenyl-3-(4-propan-2-yloxyphenyl)-4-pyrazolyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[1-phenyl-3-(4-propan-2-yloxyphenyl)pyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[3-(4-isopropoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]barbituric acid Formula: C23H20N4O4 MolecularWeight: 416.4293

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)NC(=O)NC3=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)NC(=O)NC3=O)C4=CC=CC=C4

InChI

InChI=1S/C23H20N4O4/c1-14(2)31-18-10-8-15(9-11-18)20-16(12-19-21(28)24-23(30)25-22(19)29)13-27(26-20)17-6-4-3-5-7-17/h3-14H,1-2H3,(H2,24,25,28,29,30)