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

Systemtic Name: 1-(4-iodophenyl)-5-[(1-propylindol-3-yl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(4-iodophenyl)-5-[(1-propylindol-3-yl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-iodophenyl)-5-[(1-propyl-3-indolyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-iodophenyl)-5-[(1-propylindol-3-yl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(4-iodophenyl)-5-[(1-propylindol-3-yl)methylene]barbituric acid Formula: C22H18IN3O3 MolecularWeight: 499.30109

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)I

Isomeric SMILES

CCCN1C=C(C2=CC=CC=C21)C=C3C(=O)NC(=O)N(C3=O)C4=CC=C(C=C4)I

InChI

InChI=1S/C22H18IN3O3/c1-2-11-25-13-14(17-5-3-4-6-19(17)25)12-18-20(27)24-22(29)26(21(18)28)16-9-7-15(23)8-10-16/h3-10,12-13H,2,11H2,1H3,(H,24,27,29)