tert-butyl 4-[4-(5-aminocarbonyl-3-chloranyl-pyridin-2-yl)piperazin-1-yl]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(5-aminocarbonyl-3-chloranyl-pyridin-2-yl)piperazin-1-yl]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(5-carbamoyl-3-chloro-2-pyridyl)piperazin-1-yl]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-[4-(5-carbamoyl-3-chloro-2-pyridinyl)-1-piperazinyl]-2-[oxo(3-thiazolidinyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(5-carbamoyl-3-chloropyridin-2-yl)piperazin-1-yl]-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-[4-(5-carbamoyl-3-chloro-2-pyridyl)piperazino]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C23H33ClN6O4S MolecularWeight: 525.06392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3CCN(CC3)C4=C(C=C(C=N4)C(=O)N)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3CCN(CC3)C4=C(C=C(C=N4)C(=O)N)Cl

InChI

InChI=1S/C23H33ClN6O4S/c1-23(2,3)34-22(33)30-13-16(11-18(30)21(32)29-8-9-35-14-29)27-4-6-28(7-5-27)20-17(24)10-15(12-26-20)19(25)31/h10,12,16,18H,4-9,11,13-14H2,1-3H3,(H2,25,31)