1-cyclohexyl-5-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-cyclohexyl-5-[(5-methyl-3-oxidanylidene-2-phenyl-1H-pyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-cyclohexyl-5-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-cyclohexyl-5-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-cyclohexyl-5-[(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-cyclohexyl-5-[(5-keto-3-methyl-1-phenyl-3-pyrazolin-4-yl)methylene]barbituric acid Formula: C21H22N4O4 MolecularWeight: 394.42378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C(=O)NC(=O)N(C3=O)C4CCCCC4

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC=CC=C2)C=C3C(=O)NC(=O)N(C3=O)C4CCCCC4

InChI

InChI=1S/C21H22N4O4/c1-13-16(20(28)25(23-13)15-10-6-3-7-11-15)12-17-18(26)22-21(29)24(19(17)27)14-8-4-2-5-9-14/h3,6-7,10-12,14,23H,2,4-5,8-9H2,1H3,(H,22,26,29)