tert-butyl 4-butyl-2-[(4-cyanophenyl)methylamino]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-butyl-2-[(4-cyanophenyl)methylamino]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-butyl-2-[(4-cyanophenyl)methylamino]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-butyl-2-[(4-cyanophenyl)methylamino]-2-[oxo(3-thiazolidinyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-butyl-2-[(4-cyanophenyl)methylamino]-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-butyl-2-[(4-cyanobenzyl)amino]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C25H36N4O3S MolecularWeight: 472.64334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC(N(C1)C(=O)OC(C)(C)C)(C(=O)N2CCSC2)NCC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCC1CC(N(C1)C(=O)OC(C)(C)C)(C(=O)N2CCSC2)NCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H36N4O3S/c1-5-6-7-21-14-25(22(30)28-12-13-33-18-28,29(17-21)23(31)32-24(2,3)4)27-16-20-10-8-19(15-26)9-11-20/h8-11,21,27H,5-7,12-14,16-18H2,1-4H3