5-[(1-ethylindol-3-yl)methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(1-ethylindol-3-yl)methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(1-ethylindol-3-yl)methylene]-1-(4-iodophenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(1-ethyl-3-indolyl)methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(1-ethylindol-3-yl)methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(1-ethylindol-3-yl)methylene]-1-(4-iodophenyl)barbituric acid Formula: C21H16IN3O3 MolecularWeight: 485.27451

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)I

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)I

InChI

InChI=1S/C21H16IN3O3/c1-2-24-12-13(16-5-3-4-6-18(16)24)11-17-19(26)23-21(28)25(20(17)27)15-9-7-14(22)8-10-15/h3-12H,2H2,1H3,(H,23,26,28)