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

Systemtic Name: 1-(4-iodophenyl)-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(4-iodophenyl)-5-[(3-morpholinopropylamino)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-iodophenyl)-5-[[3-(4-morpholinyl)propylamino]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-iodophenyl)-5-[(3-morpholin-4-ylpropylamino)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(4-iodophenyl)-5-[(3-morpholinopropylamino)methylene]barbituric acid Formula: C18H21IN4O4 MolecularWeight: 484.28821

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)I

Isomeric SMILES

C1COCCN1CCCNC=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C18H21IN4O4/c19-13-2-4-14(5-3-13)23-17(25)15(16(24)21-18(23)26)12-20-6-1-7-22-8-10-27-11-9-22/h2-5,12,20H,1,6-11H2,(H,21,24,26)