N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C19H23FN2O3S3 MolecularWeight: 442.590923

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCCSCC3=CC=CC=C3F

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCCSCC3=CC=CC=C3F

InChI

InChI=1S/C19H23FN2O3S3/c20-17-7-2-1-5-16(17)14-26-12-9-21-19(23)15-6-3-10-22(13-15)28(24,25)18-8-4-11-27-18/h1-2,4-5,7-8,11,15H,3,6,9-10,12-14H2,(H,21,23)