1-(4-phenoxyphenyl)-5-(4-pyrimidin-2-ylpiperazin-1-yl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 1-(4-phenoxyphenyl)-5-(4-pyrimidin-2-ylpiperazin-1-yl)-1,3-diazinane-2,4,6-trione Openeye Name: 1-(4-phenoxyphenyl)-5-(4-pyrimidin-2-ylpiperazin-1-yl)hexahydropyrimidine-2,4,6-trione CAS Name: 1-(4-phenoxyphenyl)-5-[4-(2-pyrimidinyl)-1-piperazinyl]-1,3-diazinane-2,4,6-trione IUPAC Name: 1-(4-phenoxyphenyl)-5-(4-pyrimidin-2-ylpiperazin-1-yl)-1,3-diazinane-2,4,6-trione Traditional Name: 1-(4-phenoxyphenyl)-5-[4-(2-pyrimidyl)piperazino]barbituric acid Formula: C24H22N6O4 MolecularWeight: 458.46928

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4)C5=NC=CC=N5

Isomeric SMILES

C1CN(CCN1C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4)C5=NC=CC=N5

InChI

InChI=1S/C24H22N6O4/c31-21-20(28-13-15-29(16-14-28)23-25-11-4-12-26-23)22(32)30(24(33)27-21)17-7-9-19(10-8-17)34-18-5-2-1-3-6-18/h1-12,20H,13-16H2,(H,27,31,33)