tert-butyl 4-piperazin-1-yl-4-quinolin-8-ylsulfonyl-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-piperazin-1-yl-4-quinolin-8-ylsulfonyl-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-piperazin-1-yl-4-(8-quinolylsulfonyl)-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 2-[oxo(3-thiazolidinyl)methyl]-4-(1-piperazinyl)-4-(8-quinolinylsulfonyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-piperazin-1-yl-4-quinolin-8-ylsulfonyl-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-piperazino-4-(8-quinolylsulfonyl)-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C26H35N5O5S2 MolecularWeight: 561.7166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)(N3CCNCC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)(N3CCNCC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C26H35N5O5S2/c1-25(2,3)36-24(33)31-17-26(30-12-10-27-11-13-30,16-20(31)23(32)29-14-15-37-18-29)38(34,35)21-8-4-6-19-7-5-9-28-22(19)21/h4-9,20,27H,10-18H2,1-3H3