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

Systemtic Name: tert-butyl 4-piperazin-1-yl-4-pyridin-2-yl-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-piperazin-1-yl-4-(2-pyridyl)-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 2-[oxo(3-thiazolidinyl)methyl]-4-(1-piperazinyl)-4-(2-pyridinyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-piperazin-1-yl-4-pyridin-2-yl-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-piperazino-4-(2-pyridyl)-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C22H33N5O3S MolecularWeight: 447.59412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)(C3=CC=CC=N3)N4CCNCC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)(C3=CC=CC=N3)N4CCNCC4

InChI

InChI=1S/C22H33N5O3S/c1-21(2,3)30-20(29)27-15-22(18-6-4-5-7-24-18,26-10-8-23-9-11-26)14-17(27)19(28)25-12-13-31-16-25/h4-7,17,23H,8-16H2,1-3H3