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

Systemtic Name: 5-[[(3-aminophenyl)amino]methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-aminoanilino)methylene]-1-(4-iodophenyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(3-aminoanilino)methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(3-aminoanilino)methylidene]-1-(4-iodophenyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(3-aminoanilino)methylene]-1-(4-iodophenyl)barbituric acid Formula: C17H13IN4O3 MolecularWeight: 448.21459

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)I)N

Isomeric SMILES

C1=CC(=CC(=C1)NC=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)I)N

InChI

InChI=1S/C17H13IN4O3/c18-10-4-6-13(7-5-10)22-16(24)14(15(23)21-17(22)25)9-20-12-3-1-2-11(19)8-12/h1-9,20H,19H2,(H,21,23,25)