dimethyl-[2-[4-(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylpiperazin-1-ium-1-yl]ethyl]azanium

Systemtic Name: dimethyl-[2-[4-(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylpiperazin-1-ium-1-yl]ethyl]azanium Openeye Name: dimethyl-[2-[4-[1-(2-thienylsulfonyl)piperidine-4-carbonyl]piperazin-1-ium-1-yl]ethyl]ammonium CAS Name: dimethyl-[2-[4-[oxo-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methyl]-1-piperazin-1-iumyl]ethyl]ammonium IUPAC Name: dimethyl-[2-[4-(1-thiophen-2-ylsulfonylpiperidine-4-carbonyl)piperazin-1-ium-1-yl]ethyl]azanium Traditional Name: dimethyl-[2-[4-[1-(2-thienylsulfonyl)isonipecotoyl]piperazin-1-ium-1-yl]ethyl]ammonium Formula: C18H32N4O3S2+2 MolecularWeight: 416.60168

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC[NH+]1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C[NH+](C)CC[NH+]1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H30N4O3S2/c1-19(2)9-10-20-11-13-21(14-12-20)18(23)16-5-7-22(8-6-16)27(24,25)17-4-3-15-26-17/h3-4,15-16H,5-14H2,1-2H3/p+2