1-(4-fluorophenyl)sulfonyl-N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-pyrrolidin-1-yl-butan-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)sulfonyl-N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-pyrrolidin-1-yl-butan-2-yl]piperidine-4-carboxamide Openeye Name: 1-(4-fluorophenyl)sulfonyl-N-[(1S)-3-methylsulfanyl-1-(pyrrolidine-1-carbonyl)propyl]piperidine-4-carboxamide CAS Name: 1-(4-fluorophenyl)sulfonyl-N-[(2S)-4-(methylthio)-1-oxo-1-(1-pyrrolidinyl)butan-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(4-fluorophenyl)sulfonyl-N-[(2S)-4-methylsulfanyl-1-oxo-1-pyrrolidin-1-ylbutan-2-yl]piperidine-4-carboxamide Traditional Name: 1-(4-fluorophenyl)sulfonyl-N-[(1S)-3-(methylthio)-1-(pyrrolidine-1-carbonyl)propyl]isonipecotamide Formula: C21H30FN3O4S2 MolecularWeight: 471.609003

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCCC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CSCC[C@@H](C(=O)N1CCCC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H30FN3O4S2/c1-30-15-10-19(21(27)24-11-2-3-12-24)23-20(26)16-8-13-25(14-9-16)31(28,29)18-6-4-17(22)5-7-18/h4-7,16,19H,2-3,8-15H2,1H3,(H,23,26)/t19-/m0/s1