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

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-1-(2-fluorophenyl)methanesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-1-(2-fluorophenyl)methanesulfonamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-1-(2-fluorophenyl)methanesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-1-(2-fluorophenyl)methanesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-1-(2-fluorophenyl)methanesulfonamide Formula: C19H25FN2O2S2 MolecularWeight: 396.542403

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CNS(=O)(=O)CC2=CC=CC=C2F)C3=CSC=C3

Isomeric SMILES

C1CCCN(CC1)C(CNS(=O)(=O)CC2=CC=CC=C2F)C3=CSC=C3

InChI

InChI=1S/C19H25FN2O2S2/c20-18-8-4-3-7-17(18)15-26(23,24)21-13-19(16-9-12-25-14-16)22-10-5-1-2-6-11-22/h3-4,7-9,12,14,19,21H,1-2,5-6,10-11,13,15H2