N-[[(2S)-2-cyclohexyl-1-methylsulfonyl-pyrrolidin-2-yl]methyl]-N,1-bis(fluoranyl)-3-phenyl-propan-1-amine

Systemtic Name: N-[[(2S)-2-cyclohexyl-1-methylsulfonyl-pyrrolidin-2-yl]methyl]-N,1-bis(fluoranyl)-3-phenyl-propan-1-amine Openeye Name: N-[[(2S)-2-cyclohexyl-1-methylsulfonyl-pyrrolidin-2-yl]methyl]-N,1-difluoro-3-phenyl-propan-1-amine CAS Name: N-[[(2S)-2-cyclohexyl-1-methylsulfonyl-2-pyrrolidinyl]methyl]-N,1-difluoro-3-phenyl-1-propanamine IUPAC Name: N-[[(2S)-2-cyclohexyl-1-methylsulfonylpyrrolidin-2-yl]methyl]-N,1-difluoro-3-phenylpropan-1-amine Traditional Name: [(2S)-2-cyclohexyl-1-mesyl-pyrrolidin-2-yl]methyl-fluoro-(1-fluoro-3-phenyl-propyl)amine Formula: C21H32F2N2O2S MolecularWeight: 414.552786

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC1(CN(C(CCC2=CC=CC=C2)F)F)C3CCCCC3

Isomeric SMILES

CS(=O)(=O)N1CCC[C@@]1(CN(C(CCC2=CC=CC=C2)F)F)C3CCCCC3

InChI

InChI=1S/C21H32F2N2O2S/c1-28(26,27)25-16-8-15-21(25,19-11-6-3-7-12-19)17-24(23)20(22)14-13-18-9-4-2-5-10-18/h2,4-5,9-10,19-20H,3,6-8,11-17H2,1H3/t20?,21-/m1/s1