N-[(2S)-2-(azepan-1-ium-1-yl)-2-thiophen-3-yl-ethyl]thiophene-2-sulfonamide

Systemtic Name: N-[(2S)-2-(azepan-1-ium-1-yl)-2-thiophen-3-yl-ethyl]thiophene-2-sulfonamide Openeye Name: N-[(2S)-2-(azepan-1-ium-1-yl)-2-(3-thienyl)ethyl]thiophene-2-sulfonamide CAS Name: N-[(2S)-2-(1-azepan-1-iumyl)-2-(3-thiophenyl)ethyl]-2-thiophenesulfonamide IUPAC Name: N-[(2S)-2-(azepan-1-ium-1-yl)-2-thiophen-3-ylethyl]thiophene-2-sulfonamide Traditional Name: N-[(2S)-2-(azepan-1-ium-1-yl)-2-(3-thienyl)ethyl]thiophene-2-sulfonamide Formula: C16H23N2O2S3+ MolecularWeight: 371.56102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)C(CNS(=O)(=O)C2=CC=CS2)C3=CSC=C3

Isomeric SMILES

C1CCC[NH+](CC1)[C@H](CNS(=O)(=O)C2=CC=CS2)C3=CSC=C3

InChI

InChI=1S/C16H22N2O2S3/c19-23(20,16-6-5-10-22-16)17-12-15(14-7-11-21-13-14)18-8-3-1-2-4-9-18/h5-7,10-11,13,15,17H,1-4,8-9,12H2/p+1/t15-/m1/s1