5-[(4-tert-butylphenyl)methylidene]-1-(3-chloranyl-4-methyl-phenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(4-tert-butylphenyl)methylidene]-1-(3-chloranyl-4-methyl-phenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(4-tert-butylphenyl)methylene]-1-(3-chloro-4-methyl-phenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(4-tert-butylphenyl)methylidene]-1-(3-chloro-4-methylphenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(4-tert-butylphenyl)methylidene]-1-(3-chloro-4-methylphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(4-tert-butylbenzylidene)-1-(3-chloro-4-methyl-phenyl)barbituric acid Formula: C22H21ClN2O3 MolecularWeight: 396.86674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)C(C)(C)C)C(=O)NC2=O)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)C(C)(C)C)C(=O)NC2=O)Cl

InChI

InChI=1S/C22H21ClN2O3/c1-13-5-10-16(12-18(13)23)25-20(27)17(19(26)24-21(25)28)11-14-6-8-15(9-7-14)22(2,3)4/h5-12H,1-4H3,(H,24,26,28)