tert-butyl 4-(4-pyrimidin-2-ylpiperidin-1-yl)-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-pyrimidin-2-ylpiperidin-1-yl)-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-(4-pyrimidin-2-yl-1-piperidyl)-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 2-[oxo(3-thiazolidinyl)methyl]-4-[4-(2-pyrimidinyl)-1-piperidinyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-pyrimidin-2-ylpiperidin-1-yl)-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-[4-(2-pyrimidyl)piperidino]-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)N3CCC(CC3)C4=NC=CC=N4

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3CCC(CC3)C4=NC=CC=N4

InChI

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