(5S)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-5-propyl-imidazolidine-2,4-dione

Systemtic Name: (5S)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-5-propyl-imidazolidine-2,4-dione Openeye Name: (5S)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-5-propyl-imidazolidine-2,4-dione CAS Name: (5S)-3-[[4-(3-fluorophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-5-propylimidazolidine-2,4-dione IUPAC Name: (5S)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-5-propylimidazolidine-2,4-dione Traditional Name: (5S)-3-[[4-(3-fluorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-5-propyl-hydantoin Formula: C17H24FN4O4S+ MolecularWeight: 399.460263

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=O)N(C(=O)N1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

CCC[C@H]1C(=O)N(C(=O)N1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C17H23FN4O4S/c1-2-4-15-16(23)22(17(24)19-15)12-20-7-9-21(10-8-20)27(25,26)14-6-3-5-13(18)11-14/h3,5-6,11,15H,2,4,7-10,12H2,1H3,(H,19,24)/p+1/t15-/m0/s1