N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-1-bromanyl-methanesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-1-bromanyl-methanesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-1-bromo-methanesulfonamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-1-bromomethanesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-1-bromomethanesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-1-bromo-methanesulfonamide Formula: C13H21BrN2O2S2 MolecularWeight: 381.35204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CNS(=O)(=O)CBr)C2=CSC=C2

Isomeric SMILES

C1CCCN(CC1)C(CNS(=O)(=O)CBr)C2=CSC=C2

InChI

InChI=1S/C13H21BrN2O2S2/c14-11-20(17,18)15-9-13(12-5-8-19-10-12)16-6-3-1-2-4-7-16/h5,8,10,13,15H,1-4,6-7,9,11H2