7-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-7,9-diazaspiro[4.4]nonane-6,8-dione

Systemtic Name: 7-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-7,9-diazaspiro[4.4]nonane-6,8-dione Openeye Name: 7-[[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]methyl]-7,9-diazaspiro[4.4]nonane-6,8-dione CAS Name: 7-[(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)methyl]-7,9-diazaspiro[4.4]nonane-6,8-dione IUPAC Name: 7-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-7,9-diazaspiro[4.4]nonane-6,8-dione Traditional Name: 7-[[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]methyl]-7,9-diazaspiro[4.4]nonane-6,8-quinone Formula: C16H23N4O4S2+ MolecularWeight: 399.50822

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)C(=O)N(C(=O)N2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CCC2(C1)C(=O)N(C(=O)N2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C16H22N4O4S2/c21-14-16(5-1-2-6-16)17-15(22)20(14)12-18-7-9-19(10-8-18)26(23,24)13-4-3-11-25-13/h3-4,11H,1-2,5-10,12H2,(H,17,22)/p+1