1-(3-chloranyl-4-methyl-phenyl)-5-[[2,5-dimethyl-1-(4-methyl-3-nitro-phenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-5-[[2,5-dimethyl-1-(4-methyl-3-nitro-phenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(3-chloro-4-methyl-phenyl)-5-[[2,5-dimethyl-1-(4-methyl-3-nitro-phenyl)pyrrol-3-yl]methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(3-chloro-4-methylphenyl)-5-[[2,5-dimethyl-1-(4-methyl-3-nitrophenyl)-3-pyrrolyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(3-chloro-4-methylphenyl)-5-[[2,5-dimethyl-1-(4-methyl-3-nitrophenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(3-chloro-4-methyl-phenyl)-5-[[2,5-dimethyl-1-(4-methyl-3-nitro-phenyl)pyrrol-3-yl]methylene]barbituric acid Formula: C25H21ClN4O5 MolecularWeight: 492.91104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)NC(=O)N(C3=O)C4=CC(=C(C=C4)C)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)NC(=O)N(C3=O)C4=CC(=C(C=C4)C)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C25H21ClN4O5/c1-13-5-7-18(11-21(13)26)29-24(32)20(23(31)27-25(29)33)10-17-9-15(3)28(16(17)4)19-8-6-14(2)22(12-19)30(34)35/h5-12H,1-4H3,(H,27,31,33)