N-[3-(4-fluorophenyl)sulfanylpropyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[3-[(4-fluorophenyl)thio]propyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[3-[(4-fluorophenyl)thio]propyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C19H23FN2O3S3 MolecularWeight: 442.590923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCCSC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCC1C(=O)NCCCSC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CS3

InChI

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