1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 1-(p-tolyl)-5-[1-(3-pyridylmethylamino)propylidene]hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-methylphenyl)-5-[1-(3-pyridinylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-methylphenyl)-5-[1-(pyridin-3-ylmethylamino)propylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-(p-tolyl)-5-[1-(3-pyridylmethylamino)propylidene]barbituric acid Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)C)NCC3=CN=CC=C3

Isomeric SMILES

CCC(=C1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)C)NCC3=CN=CC=C3

InChI

InChI=1S/C20H20N4O3/c1-3-16(22-12-14-5-4-10-21-11-14)17-18(25)23-20(27)24(19(17)26)15-8-6-13(2)7-9-15/h4-11,22H,3,12H2,1-2H3,(H,23,25,27)