(5R)-5-butyl-5-(4-fluorophenyl)-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4-dione

Systemtic Name: (5R)-5-butyl-5-(4-fluorophenyl)-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4-dione Openeye Name: (5R)-5-butyl-5-(4-fluorophenyl)-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4-dione CAS Name: (5R)-5-butyl-5-(4-fluorophenyl)-3-[[4-(4-pyridin-1-iumyl)-1-piperazin-1-iumyl]methyl]imidazolidine-2,4-dione IUPAC Name: (5R)-5-butyl-5-(4-fluorophenyl)-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]imidazolidine-2,4-dione Traditional Name: (5R)-5-butyl-5-(4-fluorophenyl)-3-[(4-pyridin-1-ium-4-ylpiperazin-1-ium-1-yl)methyl]hydantoin Formula: C23H30FN5O2+2 MolecularWeight: 427.515003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)N(C(=O)N1)C[NH+]2CCN(CC2)C3=CC=[NH+]C=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CCCC[C@]1(C(=O)N(C(=O)N1)C[NH+]2CCN(CC2)C3=CC=[NH+]C=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H28FN5O2/c1-2-3-10-23(18-4-6-19(24)7-5-18)21(30)29(22(31)26-23)17-27-13-15-28(16-14-27)20-8-11-25-12-9-20/h4-9,11-12H,2-3,10,13-17H2,1H3,(H,26,31)/p+2/t23-/m1/s1