tert-butyl 4-[4-(5-bromanyl-2,3-dihydroindol-1-yl)piperidin-1-yl]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(5-bromanyl-2,3-dihydroindol-1-yl)piperidin-1-yl]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(5-bromoindolin-1-yl)-1-piperidyl]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-[4-(5-bromo-2,3-dihydroindol-1-yl)-1-piperidinyl]-2-[oxo(3-thiazolidinyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(5-bromo-2,3-dihydroindol-1-yl)piperidin-1-yl]-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-[4-(5-bromoindolin-1-yl)piperidino]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C26H37BrN4O3S MolecularWeight: 565.56598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3CCC(CC3)N4CCC5=C4C=CC(=C5)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3CCC(CC3)N4CCC5=C4C=CC(=C5)Br

InChI

InChI=1S/C26H37BrN4O3S/c1-26(2,3)34-25(33)31-16-21(15-23(31)24(32)29-12-13-35-17-29)28-9-7-20(8-10-28)30-11-6-18-14-19(27)4-5-22(18)30/h4-5,14,20-21,23H,6-13,15-17H2,1-3H3