5-[[1-(4-methylphenyl)pyrazol-4-yl]methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[1-(4-methylphenyl)pyrazol-4-yl]methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione Openeye Name: 1-phenethyl-5-[[1-(p-tolyl)pyrazol-4-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[1-(4-methylphenyl)-4-pyrazolyl]methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[1-(4-methylphenyl)pyrazol-4-yl]methylidene]-1-phenethyl-1,3-diazinane-2,4,6-trione Traditional Name: 1-phenethyl-5-[[1-(p-tolyl)pyrazol-4-yl]methylene]barbituric acid Formula: C23H20N4O3 MolecularWeight: 400.4299

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C=N2)C=C3C(=O)NC(=O)N(C3=O)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C=N2)C=C3C(=O)NC(=O)N(C3=O)CCC4=CC=CC=C4

InChI

InChI=1S/C23H20N4O3/c1-16-7-9-19(10-8-16)27-15-18(14-24-27)13-20-21(28)25-23(30)26(22(20)29)12-11-17-5-3-2-4-6-17/h2-10,13-15H,11-12H2,1H3,(H,25,28,30)