(3S)-1-(4-fluorophenyl)sulfonyl-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]piperidine-3-carboxamide Openeye Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-(3-thienylmethylsulfanyl)phenyl]piperidine-3-carboxamide CAS Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-(3-thiophenylmethylthio)phenyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]piperidine-3-carboxamide Traditional Name: (3S)-1-(4-fluorophenyl)sulfonyl-N-[2-(3-thenylthio)phenyl]nipecotamide Formula: C23H23FN2O3S3 MolecularWeight: 490.633723

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC3=CC=CC=C3SCC4=CSC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NC3=CC=CC=C3SCC4=CSC=C4

InChI

InChI=1S/C23H23FN2O3S3/c24-19-7-9-20(10-8-19)32(28,29)26-12-3-4-18(14-26)23(27)25-21-5-1-2-6-22(21)31-16-17-11-13-30-15-17/h1-2,5-11,13,15,18H,3-4,12,14,16H2,(H,25,27)/t18-/m0/s1