(2R)-1-[2-[3-cyano-4-(4-fluorophenyl)-6-phenyl-pyridin-2-yl]sulfanylethanoyl]pyrrolidine-2-carboxylate

Systemtic Name: (2R)-1-[2-[3-cyano-4-(4-fluorophenyl)-6-phenyl-pyridin-2-yl]sulfanylethanoyl]pyrrolidine-2-carboxylate Openeye Name: (2R)-1-[2-[[3-cyano-4-(4-fluorophenyl)-6-phenyl-2-pyridyl]sulfanyl]acetyl]pyrrolidine-2-carboxylate CAS Name: (2R)-1-[2-[[3-cyano-4-(4-fluorophenyl)-6-phenyl-2-pyridinyl]thio]-1-oxoethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2R)-1-[2-[3-cyano-4-(4-fluorophenyl)-6-phenylpyridin-2-yl]sulfanylacetyl]pyrrolidine-2-carboxylate Traditional Name: (2R)-1-[2-[[3-cyano-4-(4-fluorophenyl)-6-phenyl-2-pyridyl]thio]acetyl]pyrrolidine-2-carboxylate Formula: C25H19FN3O3S- MolecularWeight: 460.500063

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)F)C#N)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](N(C1)C(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)F)C#N)C(=O)[O-]

InChI

InChI=1S/C25H20FN3O3S/c26-18-10-8-16(9-11-18)19-13-21(17-5-2-1-3-6-17)28-24(20(19)14-27)33-15-23(30)29-12-4-7-22(29)25(31)32/h1-3,5-6,8-11,13,22H,4,7,12,15H2,(H,31,32)/p-1/t22-/m1/s1