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

Systemtic Name: 5-[[1-(3-iodanylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-1-methyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[[1-(3-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-1-methyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[1-(3-iodophenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-1-methyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[[1-(3-iodophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-methyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[[1-(3-iodophenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-1-methyl-barbituric acid Formula: C18H16IN3O3 MolecularWeight: 449.24241

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC=C2)I)C)C=C3C(=O)NC(=O)N(C3=O)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC=C2)I)C)C=C3C(=O)NC(=O)N(C3=O)C

InChI

InChI=1S/C18H16IN3O3/c1-10-7-12(8-15-16(23)20-18(25)21(3)17(15)24)11(2)22(10)14-6-4-5-13(19)9-14/h4-9H,1-3H3,(H,20,23,25)