5-[3-(4-butoxyphenyl)-4-(2-hydroxyphenyl)piperazin-1-yl]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[3-(4-butoxyphenyl)-4-(2-hydroxyphenyl)piperazin-1-yl]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[3-(4-butoxyphenyl)-4-(2-hydroxyphenyl)piperazin-1-yl]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[3-(4-butoxyphenyl)-4-(2-hydroxyphenyl)-1-piperazinyl]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[3-(4-butoxyphenyl)-4-(2-hydroxyphenyl)piperazin-1-yl]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[3-(4-butoxyphenyl)-4-(2-hydroxyphenyl)piperazino]barbituric acid Formula: C24H28N4O5 MolecularWeight: 452.50292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2CN(CCN2C3=CC=CC=C3O)C4C(=O)NC(=O)NC4=O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2CN(CCN2C3=CC=CC=C3O)C4C(=O)NC(=O)NC4=O

InChI

InChI=1S/C24H28N4O5/c1-2-3-14-33-17-10-8-16(9-11-17)19-15-27(21-22(30)25-24(32)26-23(21)31)12-13-28(19)18-6-4-5-7-20(18)29/h4-11,19,21,29H,2-3,12-15H2,1H3,(H2,25,26,30,31,32)