1-(4-fluorophenyl)sulfonyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrrolidine-2-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-[2-(2-thienylmethylsulfanyl)ethyl]pyrrolidine-2-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-[2-(thiophen-2-ylmethylthio)ethyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrrolidine-2-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-[2-(2-thenylthio)ethyl]pyrrolidine-2-carboxamide Formula: C18H21FN2O3S3 MolecularWeight: 428.564343

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCSCC3=CC=CS3

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)NCCSCC3=CC=CS3

InChI

InChI=1S/C18H21FN2O3S3/c19-14-5-7-16(8-6-14)27(23,24)21-10-1-4-17(21)18(22)20-9-12-25-13-15-3-2-11-26-15/h2-3,5-8,11,17H,1,4,9-10,12-13H2,(H,20,22)