1-[[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-propyl-imidazolidine-2,4,5-trione

Systemtic Name: 1-[[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-propyl-imidazolidine-2,4,5-trione Openeye Name: 1-[[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-propyl-imidazolidine-2,4,5-trione CAS Name: 1-[[4-(3-bromophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-3-propylimidazolidine-2,4,5-trione IUPAC Name: 1-[[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-propylimidazolidine-2,4,5-trione Traditional Name: 1-[[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-propyl-imidazolidine-2,4,5-trione Formula: C17H22BrN4O5S+ MolecularWeight: 474.34938

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=O)N(C1=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCN1C(=O)C(=O)N(C1=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H21BrN4O5S/c1-2-6-21-15(23)16(24)22(17(21)25)12-19-7-9-20(10-8-19)28(26,27)14-5-3-4-13(18)11-14/h3-5,11H,2,6-10,12H2,1H3/p+1