tert-butyl 4-(2-phenylquinolin-4-yl)-4-piperazin-1-yl-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-phenylquinolin-4-yl)-4-piperazin-1-yl-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-(2-phenyl-4-quinolyl)-4-piperazin-1-yl-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 2-[oxo(3-thiazolidinyl)methyl]-4-(2-phenyl-4-quinolinyl)-4-(1-piperazinyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-phenylquinolin-4-yl)-4-piperazin-1-yl-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-(2-phenyl-4-quinolyl)-4-piperazino-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C32H39N5O3S MolecularWeight: 573.74876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)(C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)N6CCNCC6

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)(C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)N6CCNCC6

InChI

InChI=1S/C32H39N5O3S/c1-31(2,3)40-30(39)37-21-32(36-15-13-33-14-16-36,20-28(37)29(38)35-17-18-41-22-35)25-19-27(23-9-5-4-6-10-23)34-26-12-8-7-11-24(25)26/h4-12,19,28,33H,13-18,20-22H2,1-3H3