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

Systemtic Name: 1-(4-methylphenyl)-5-[1-(3-piperidin-1-ylpropylamino)propylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[1-[3-(1-piperidyl)propylamino]propylidene]-1-(p-tolyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-methylphenyl)-5-[1-[3-(1-piperidinyl)propylamino]propylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-methylphenyl)-5-[1-(3-piperidin-1-ylpropylamino)propylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[1-(3-piperidinopropylamino)propylidene]-1-(p-tolyl)barbituric acid Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)C)NCCCN3CCCCC3

Isomeric SMILES

CCC(=C1C(=O)NC(=O)N(C1=O)C2=CC=C(C=C2)C)NCCCN3CCCCC3

InChI

InChI=1S/C22H30N4O3/c1-3-18(23-12-7-15-25-13-5-4-6-14-25)19-20(27)24-22(29)26(21(19)28)17-10-8-16(2)9-11-17/h8-11,23H,3-7,12-15H2,1-2H3,(H,24,27,29)