(2R)-N-(1-cyanocyclopropyl)-3-(phenylmethyl)sulfonyl-2-[[(1S)-2,2,2-tris(fluoranyl)-1-(furan-2-yl)ethyl]amino]propanamide

Systemtic Name: (2R)-N-(1-cyanocyclopropyl)-3-(phenylmethyl)sulfonyl-2-[[(1S)-2,2,2-tris(fluoranyl)-1-(furan-2-yl)ethyl]amino]propanamide Openeye Name: (2R)-3-benzylsulfonyl-N-(1-cyanocyclopropyl)-2-[[(1S)-2,2,2-trifluoro-1-(2-furyl)ethyl]amino]propanamide CAS Name: (2R)-N-(1-cyanocyclopropyl)-3-(phenylmethyl)sulfonyl-2-[[(1S)-2,2,2-trifluoro-1-(2-furanyl)ethyl]amino]propanamide IUPAC Name: (2R)-3-benzylsulfonyl-N-(1-cyanocyclopropyl)-2-[[(1S)-2,2,2-trifluoro-1-(furan-2-yl)ethyl]amino]propanamide Traditional Name: (2R)-3-benzylsulfonyl-N-(1-cyanocyclopropyl)-2-[[(1S)-2,2,2-trifluoro-1-(2-furyl)ethyl]amino]propionamide Formula: C20H20F3N3O4S MolecularWeight: 455.45071

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(C#N)NC(=O)C(CS(=O)(=O)CC2=CC=CC=C2)NC(C3=CC=CO3)C(F)(F)F

Isomeric SMILES

C1CC1(C#N)NC(=O)[C@H](CS(=O)(=O)CC2=CC=CC=C2)N[C@@H](C3=CC=CO3)C(F)(F)F

InChI

InChI=1S/C20H20F3N3O4S/c21-20(22,23)17(16-7-4-10-30-16)25-15(18(27)26-19(13-24)8-9-19)12-31(28,29)11-14-5-2-1-3-6-14/h1-7,10,15,17,25H,8-9,11-12H2,(H,26,27)/t15-,17-/m0/s1