1-[[4-(phenylmethyl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-(2-thiophen-2-ylethyl)imidazolidine-2,4,5-trione

Systemtic Name: 1-[[4-(phenylmethyl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-(2-thiophen-2-ylethyl)imidazolidine-2,4,5-trione Openeye Name: 1-[(4-benzylsulfonylpiperazin-1-ium-1-yl)methyl]-3-[2-(2-thienyl)ethyl]imidazolidine-2,4,5-trione CAS Name: 1-[[4-(phenylmethyl)sulfonyl-1-piperazin-1-iumyl]methyl]-3-(2-thiophen-2-ylethyl)imidazolidine-2,4,5-trione IUPAC Name: 1-[(4-benzylsulfonylpiperazin-1-ium-1-yl)methyl]-3-(2-thiophen-2-ylethyl)imidazolidine-2,4,5-trione Traditional Name: 1-[(4-benzylsulfonylpiperazin-1-ium-1-yl)methyl]-3-[2-(2-thienyl)ethyl]imidazolidine-2,4,5-trione Formula: C21H25N4O5S2+ MolecularWeight: 477.577

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C(=O)C(=O)N(C2=O)CCC3=CC=CS3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CN2C(=O)C(=O)N(C2=O)CCC3=CC=CS3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H24N4O5S2/c26-19-20(27)25(21(28)24(19)9-8-18-7-4-14-31-18)16-22-10-12-23(13-11-22)32(29,30)15-17-5-2-1-3-6-17/h1-7,14H,8-13,15-16H2/p+1