tert-butyl 4-[8-methyl-2-(trifluoromethyl)quinolin-4-yl]-4-piperazin-1-yl-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-[8-methyl-2-(trifluoromethyl)quinolin-4-yl]-4-piperazin-1-yl-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-[8-methyl-2-(trifluoromethyl)-4-quinolyl]-4-piperazin-1-yl-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-[8-methyl-2-(trifluoromethyl)-4-quinolinyl]-2-[oxo(3-thiazolidinyl)methyl]-4-(1-piperazinyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[8-methyl-2-(trifluoromethyl)quinolin-4-yl]-4-piperazin-1-yl-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-[8-methyl-2-(trifluoromethyl)-4-quinolyl]-4-piperazino-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C28H36F3N5O3S MolecularWeight: 579.67735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C3(CC(N(C3)C(=O)OC(C)(C)C)C(=O)N4CCSC4)N5CCNCC5)C(F)(F)F

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C3(CC(N(C3)C(=O)OC(C)(C)C)C(=O)N4CCSC4)N5CCNCC5)C(F)(F)F

InChI

InChI=1S/C28H36F3N5O3S/c1-18-6-5-7-19-20(14-22(28(29,30)31)33-23(18)19)27(35-10-8-32-9-11-35)15-21(24(37)34-12-13-40-17-34)36(16-27)25(38)39-26(2,3)4/h5-7,14,21,32H,8-13,15-17H2,1-4H3