5-ethyl-N-[[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]thiophene-2-sulfonamide

Systemtic Name: 5-ethyl-N-[[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]thiophene-2-sulfonamide Openeye Name: 5-ethyl-N-[[1-(2-thienylmethyl)piperidin-1-ium-4-yl]methyl]thiophene-2-sulfonamide CAS Name: 5-ethyl-N-[[1-(thiophen-2-ylmethyl)-4-piperidin-1-iumyl]methyl]-2-thiophenesulfonamide IUPAC Name: 5-ethyl-N-[[1-(thiophen-2-ylmethyl)piperidin-1-ium-4-yl]methyl]thiophene-2-sulfonamide Traditional Name: 5-ethyl-N-[[1-(2-thenyl)piperidin-1-ium-4-yl]methyl]thiophene-2-sulfonamide Formula: C17H25N2O2S3+ MolecularWeight: 385.5876

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)S(=O)(=O)NCC2CC[NH+](CC2)CC3=CC=CS3

Isomeric SMILES

CCC1=CC=C(S1)S(=O)(=O)NCC2CC[NH+](CC2)CC3=CC=CS3

InChI

InChI=1S/C17H24N2O2S3/c1-2-15-5-6-17(23-15)24(20,21)18-12-14-7-9-19(10-8-14)13-16-4-3-11-22-16/h3-6,11,14,18H,2,7-10,12-13H2,1H3/p+1