tert-butyl 4-[(4-cyanophenyl)methyl-(2-oxidanylidene-2-propan-2-yloxy-ethyl)amino]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(4-cyanophenyl)methyl-(2-oxidanylidene-2-propan-2-yloxy-ethyl)amino]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-[(4-cyanophenyl)methyl-(2-isopropoxy-2-oxo-ethyl)amino]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-[(4-cyanophenyl)methyl-(2-oxo-2-propan-2-yloxyethyl)amino]-2-[oxo(3-thiazolidinyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-cyanophenyl)methyl-(2-oxo-2-propan-2-yloxyethyl)amino]-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-[(4-cyanobenzyl)-(2-isopropoxy-2-keto-ethyl)amino]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C26H36N4O5S MolecularWeight: 516.65284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CN(CC1=CC=C(C=C1)C#N)C2CC(N(C2)C(=O)OC(C)(C)C)C(=O)N3CCSC3

Isomeric SMILES

CC(C)OC(=O)CN(CC1=CC=C(C=C1)C#N)C2CC(N(C2)C(=O)OC(C)(C)C)C(=O)N3CCSC3

InChI

InChI=1S/C26H36N4O5S/c1-18(2)34-23(31)16-29(14-20-8-6-19(13-27)7-9-20)21-12-22(24(32)28-10-11-36-17-28)30(15-21)25(33)35-26(3,4)5/h6-9,18,21-22H,10-12,14-17H2,1-5H3