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

Systemtic Name: 1-[[4-(phenylsulfonyl)piperazin-1-ium-1-yl]methyl]-3-(thiophen-2-ylmethyl)imidazolidine-2,4,5-trione Openeye Name: 1-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]-3-(2-thienylmethyl)imidazolidine-2,4,5-trione CAS Name: 1-[[4-(benzenesulfonyl)-1-piperazin-1-iumyl]methyl]-3-(thiophen-2-ylmethyl)imidazolidine-2,4,5-trione IUPAC Name: 1-[[4-(benzenesulfonyl)piperazin-1-ium-1-yl]methyl]-3-(thiophen-2-ylmethyl)imidazolidine-2,4,5-trione Traditional Name: 1-[(4-besylpiperazin-1-ium-1-yl)methyl]-3-(2-thenyl)imidazolidine-2,4,5-trione Formula: C19H21N4O5S2+ MolecularWeight: 449.52384

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C(=O)C(=O)N(C2=O)CC3=CC=CS3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CN2C(=O)C(=O)N(C2=O)CC3=CC=CS3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H20N4O5S2/c24-17-18(25)23(19(26)22(17)13-15-5-4-12-29-15)14-20-8-10-21(11-9-20)30(27,28)16-6-2-1-3-7-16/h1-7,12H,8-11,13-14H2/p+1