N-[[(3S)-1-[(5-cyclopentylthiophen-2-yl)methyl]piperidin-1-ium-3-yl]methyl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[[(3S)-1-[(5-cyclopentylthiophen-2-yl)methyl]piperidin-1-ium-3-yl]methyl]-1-phenyl-methanesulfonamide Openeye Name: N-[[(3S)-1-[(5-cyclopentyl-2-thienyl)methyl]piperidin-1-ium-3-yl]methyl]-1-phenyl-methanesulfonamide CAS Name: N-[[(3S)-1-[(5-cyclopentyl-2-thiophenyl)methyl]-3-piperidin-1-iumyl]methyl]-1-phenylmethanesulfonamide IUPAC Name: N-[[(3S)-1-[(5-cyclopentylthiophen-2-yl)methyl]piperidin-1-ium-3-yl]methyl]-1-phenylmethanesulfonamide Traditional Name: N-[[(3S)-1-[(5-cyclopentyl-2-thienyl)methyl]piperidin-1-ium-3-yl]methyl]-1-phenyl-methanesulfonamide Formula: C23H33N2O2S2+ MolecularWeight: 433.65032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=CC=C(S2)C[NH+]3CCCC(C3)CNS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)C2=CC=C(S2)C[NH+]3CCC[C@@H](C3)CNS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H32N2O2S2/c26-29(27,18-19-7-2-1-3-8-19)24-15-20-9-6-14-25(16-20)17-22-12-13-23(28-22)21-10-4-5-11-21/h1-3,7-8,12-13,20-21,24H,4-6,9-11,14-18H2/p+1/t20-/m1/s1