1-(4-chlorophenyl)-5-[[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(4-chlorophenyl)-5-[[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(4-chlorophenyl)-5-[[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-chlorophenyl)-5-[[1-(4-ethylphenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-chlorophenyl)-5-[[1-(4-ethylphenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(4-chlorophenyl)-5-[[1-(4-ethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]barbituric acid Formula: C25H22ClN3O3 MolecularWeight: 447.91348

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C25H22ClN3O3/c1-4-17-5-9-20(10-6-17)28-15(2)13-18(16(28)3)14-22-23(30)27-25(32)29(24(22)31)21-11-7-19(26)8-12-21/h5-14H,4H2,1-3H3,(H,27,30,32)