1-(2-azanyl-3-phenyl-propanoyl)-2-[2,2,2-tris(fluoranyl)ethylsulfonyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(2-azanyl-3-phenyl-propanoyl)-2-[2,2,2-tris(fluoranyl)ethylsulfonyl]pyrrolidine-2-carboxamide Openeye Name: 1-(2-amino-3-phenyl-propanoyl)-2-(2,2,2-trifluoroethylsulfonyl)pyrrolidine-2-carboxamide CAS Name: 1-(2-amino-1-oxo-3-phenylpropyl)-2-(2,2,2-trifluoroethylsulfonyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(2-amino-3-phenylpropanoyl)-2-(2,2,2-trifluoroethylsulfonyl)pyrrolidine-2-carboxamide Traditional Name: 1-phenylalanyl-2-(2,2,2-trifluoroethylsulfonyl)pyrrolidine-2-carboxamide Formula: C16H20F3N3O4S MolecularWeight: 407.40791

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)N)(C(=O)N)S(=O)(=O)CC(F)(F)F

Isomeric SMILES

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)N)(C(=O)N)S(=O)(=O)CC(F)(F)F

InChI

InChI=1S/C16H20F3N3O4S/c17-16(18,19)10-27(25,26)15(14(21)24)7-4-8-22(15)13(23)12(20)9-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10,20H2,(H2,21,24)