ethanoic acid; 5-[[3-(2-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: ethanoic acid; 5-[[3-(2-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: acetic acid; 5-[[3-(2-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: acetic acid; 5-[[3-(2-methyl-4-propoxyphenyl)-1-phenyl-4-pyrazolyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: acetic acid; 5-[[3-(2-methyl-4-propoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: acetic acid; 5-[[3-(2-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylene]barbituric acid Formula: C26H26N4O6 MolecularWeight: 490.50784

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)C2=NN(C=C2C=C3C(=O)NC(=O)NC3=O)C4=CC=CC=C4)C.CC(=O)O

Isomeric SMILES

CCCOC1=CC(=C(C=C1)C2=NN(C=C2C=C3C(=O)NC(=O)NC3=O)C4=CC=CC=C4)C.CC(=O)O

InChI

InChI=1S/C24H22N4O4.C2H4O2/c1-3-11-32-18-9-10-19(15(2)12-18)21-16(13-20-22(29)25-24(31)26-23(20)30)14-28(27-21)17-7-5-4-6-8-17;1-2(3)4/h4-10,12-14H,3,11H2,1-2H3,(H2,25,26,29,30,31);1H3,(H,3,4)