5-[1-[2-(4-ethanoylpiperazin-1-yl)ethylamino]propylidene]-1-phenyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[1-[2-(4-ethanoylpiperazin-1-yl)ethylamino]propylidene]-1-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[1-[2-(4-acetylpiperazin-1-yl)ethylamino]propylidene]-1-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[1-[2-(4-acetyl-1-piperazinyl)ethylamino]propylidene]-1-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[1-[2-(4-acetylpiperazin-1-yl)ethylamino]propylidene]-1-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[1-[2-(4-acetylpiperazino)ethylamino]propylidene]-1-phenyl-barbituric acid Formula: C21H27N5O4 MolecularWeight: 413.47018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2)NCCN3CCN(CC3)C(=O)C

Isomeric SMILES

CCC(=C1C(=O)NC(=O)N(C1=O)C2=CC=CC=C2)NCCN3CCN(CC3)C(=O)C

InChI

InChI=1S/C21H27N5O4/c1-3-17(22-9-10-24-11-13-25(14-12-24)15(2)27)18-19(28)23-21(30)26(20(18)29)16-7-5-4-6-8-16/h4-8,22H,3,9-14H2,1-2H3,(H,23,28,30)