methyl (3S,4R)-1-[3-chloranyl-5-[[4-[2-fluoranyl-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]pyridin-2-yl]-4-phenyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl (3S,4R)-1-[3-chloranyl-5-[[4-[2-fluoranyl-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]pyridin-2-yl]-4-phenyl-pyrrolidine-3-carboxylate Openeye Name: methyl (3S,4R)-1-[3-chloro-5-[[4-[2-fluoro-3-(trifluoromethyl)phenyl]thiazol-2-yl]carbamoyl]-2-pyridyl]-4-phenyl-pyrrolidine-3-carboxylate CAS Name: (3S,4R)-1-[3-chloro-5-[[[4-[2-fluoro-3-(trifluoromethyl)phenyl]-2-thiazolyl]amino]-oxomethyl]-2-pyridinyl]-4-phenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (3S,4R)-1-[3-chloro-5-[[4-[2-fluoro-3-(trifluoromethyl)phenyl]-1,3-thiazol-2-yl]carbamoyl]pyridin-2-yl]-4-phenylpyrrolidine-3-carboxylate Traditional Name: (3S,4R)-1-[3-chloro-5-[[4-[2-fluoro-3-(trifluoromethyl)phenyl]thiazol-2-yl]carbamoyl]-2-pyridyl]-4-phenyl-pyrrolidine-3-carboxylic acid methyl ester Formula: C28H21ClF4N4O3S MolecularWeight: 605.002953

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CC1C2=CC=CC=C2)C3=C(C=C(C=N3)C(=O)NC4=NC(=CS4)C5=C(C(=CC=C5)C(F)(F)F)F)Cl

Isomeric SMILES

COC(=O)[C@@H]1CN(C[C@H]1C2=CC=CC=C2)C3=C(C=C(C=N3)C(=O)NC4=NC(=CS4)C5=C(C(=CC=C5)C(F)(F)F)F)Cl

InChI

InChI=1S/C28H21ClF4N4O3S/c1-40-26(39)19-13-37(12-18(19)15-6-3-2-4-7-15)24-21(29)10-16(11-34-24)25(38)36-27-35-22(14-41-27)17-8-5-9-20(23(17)30)28(31,32)33/h2-11,14,18-19H,12-13H2,1H3,(H,35,36,38)/t18-,19+/m0/s1