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

Systemtic Name: 5-[(2-diethylaminoethylamino)methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(2-diethylaminoethylamino)methylene]-1-(4-iodophenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(2-diethylaminoethylamino)methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(2-diethylaminoethylamino)methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(2-diethylaminoethylamino)methylene]-1-(4-iodophenyl)barbituric acid Formula: C17H21IN4O3 MolecularWeight: 456.27811

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC=C1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)I

Isomeric SMILES

CCN(CC)CCNC=C1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C17H21IN4O3/c1-3-21(4-2)10-9-19-11-14-15(23)20-17(25)22(16(14)24)13-7-5-12(18)6-8-13/h5-8,11,19H,3-4,9-10H2,1-2H3,(H,20,23,25)