5-ethyl-1-(5-oxidanylidene-5-piperazin-1-yl-pentyl)-5-phenyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-ethyl-1-(5-oxidanylidene-5-piperazin-1-yl-pentyl)-5-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-ethyl-1-(5-oxo-5-piperazin-1-yl-pentyl)-5-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-ethyl-1-[5-oxo-5-(1-piperazinyl)pentyl]-5-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-ethyl-1-(5-oxo-5-piperazin-1-ylpentyl)-5-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-ethyl-1-(5-keto-5-piperazino-pentyl)-5-phenyl-barbituric acid Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)NC(=O)N(C1=O)CCCCC(=O)N2CCNCC2)C3=CC=CC=C3

Isomeric SMILES

CCC1(C(=O)NC(=O)N(C1=O)CCCCC(=O)N2CCNCC2)C3=CC=CC=C3

InChI

InChI=1S/C21H28N4O4/c1-2-21(16-8-4-3-5-9-16)18(27)23-20(29)25(19(21)28)13-7-6-10-17(26)24-14-11-22-12-15-24/h3-5,8-9,22H,2,6-7,10-15H2,1H3,(H,23,27,29)