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

Systemtic Name: tert-butyl 4-[(4-cyanophenyl)methyl-(2-oxidanylidene-2-phenylmethoxy-ethyl)amino]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-[(2-benzyloxy-2-oxo-ethyl)-[(4-cyanophenyl)methyl]amino]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-[(4-cyanophenyl)methyl-(2-oxo-2-phenylmethoxyethyl)amino]-2-[oxo(3-thiazolidinyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(4-cyanophenyl)methyl-(2-oxo-2-phenylmethoxyethyl)amino]-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-[(2-benzoxy-2-keto-ethyl)-(4-cyanobenzyl)amino]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C30H36N4O5S MolecularWeight: 564.69564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N(CC3=CC=C(C=C3)C#N)CC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N(CC3=CC=C(C=C3)C#N)CC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C30H36N4O5S/c1-30(2,3)39-29(37)34-18-25(15-26(34)28(36)32-13-14-40-21-32)33(17-23-11-9-22(16-31)10-12-23)19-27(35)38-20-24-7-5-4-6-8-24/h4-12,25-26H,13-15,17-21H2,1-3H3