5,5-diphenyl-3-[4-(1-pyrimidin-2-ylpiperazin-1-ium-1-yl)butyl]imidazolidine-2,4-dione

Systemtic Name: 5,5-diphenyl-3-[4-(1-pyrimidin-2-ylpiperazin-1-ium-1-yl)butyl]imidazolidine-2,4-dione Openeye Name: 5,5-diphenyl-3-[4-(1-pyrimidin-2-ylpiperazin-1-ium-1-yl)butyl]imidazolidine-2,4-dione CAS Name: 5,5-diphenyl-3-[4-[1-(2-pyrimidinyl)-1-piperazin-1-iumyl]butyl]imidazolidine-2,4-dione IUPAC Name: 5,5-diphenyl-3-[4-(1-pyrimidin-2-ylpiperazin-1-ium-1-yl)butyl]imidazolidine-2,4-dione Traditional Name: 5,5-diphenyl-3-[4-[1-(2-pyrimidyl)piperazin-1-ium-1-yl]butyl]hydantoin Formula: C27H31N6O2+ MolecularWeight: 471.57404

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCN1)(CCCCN2C(=O)C(NC2=O)(C3=CC=CC=C3)C4=CC=CC=C4)C5=NC=CC=N5

Isomeric SMILES

C1C[N+](CCN1)(CCCCN2C(=O)C(NC2=O)(C3=CC=CC=C3)C4=CC=CC=C4)C5=NC=CC=N5

InChI

InChI=1S/C27H30N6O2/c34-24-27(22-10-3-1-4-11-22,23-12-5-2-6-13-23)31-26(35)32(24)18-7-8-19-33(20-16-28-17-21-33)25-29-14-9-15-30-25/h1-6,9-15,28H,7-8,16-21H2/p+1