1-(3-chloranyl-4-methoxy-phenyl)-5-[[1-(phenylmethyl)pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(3-chloranyl-4-methoxy-phenyl)-5-[[1-(phenylmethyl)pyrrol-2-yl]methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(1-benzylpyrrol-2-yl)methylene]-1-(3-chloro-4-methoxy-phenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-(3-chloro-4-methoxyphenyl)-5-[[1-(phenylmethyl)-2-pyrrolyl]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(1-benzylpyrrol-2-yl)methylidene]-1-(3-chloro-4-methoxyphenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(1-benzylpyrrol-2-yl)methylene]-1-(3-chloro-4-methoxy-phenyl)barbituric acid Formula: C23H18ClN3O4 MolecularWeight: 435.85972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=CN3CC4=CC=CC=C4)C(=O)NC2=O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=CN3CC4=CC=CC=C4)C(=O)NC2=O)Cl

InChI

InChI=1S/C23H18ClN3O4/c1-31-20-10-9-17(13-19(20)24)27-22(29)18(21(28)25-23(27)30)12-16-8-5-11-26(16)14-15-6-3-2-4-7-15/h2-13H,14H2,1H3,(H,25,28,30)