1-[[4-(phenylsulfonyl)piperazin-1-ium-1-yl]methyl]-3-propan-2-yl-imidazolidine-2,4,5-trione

Systemtic Name: 1-[[4-(phenylsulfonyl)piperazin-1-ium-1-yl]methyl]-3-propan-2-yl-imidazolidine-2,4,5-trione Openeye Name: 1-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]-3-isopropyl-imidazolidine-2,4,5-trione CAS Name: 1-[[4-(benzenesulfonyl)-1-piperazin-1-iumyl]methyl]-3-propan-2-ylimidazolidine-2,4,5-trione IUPAC Name: 1-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]-3-propan-2-ylimidazolidine-2,4,5-trione Traditional Name: 1-[(4-besylpiperazin-1-ium-1-yl)methyl]-3-isopropyl-imidazolidine-2,4,5-trione Formula: C17H23N4O5S+ MolecularWeight: 395.45332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C(=O)N(C1=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)N1C(=O)C(=O)N(C1=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H22N4O5S/c1-13(2)21-16(23)15(22)20(17(21)24)12-18-8-10-19(11-9-18)27(25,26)14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3/p+1