tert-butyl 4-(4-quinazolin-4-ylpiperazin-1-yl)-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-quinazolin-4-ylpiperazin-1-yl)-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-(4-quinazolin-4-ylpiperazin-1-yl)-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 2-[oxo(3-thiazolidinyl)methyl]-4-[4-(4-quinazolinyl)-1-piperazinyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-quinazolin-4-ylpiperazin-1-yl)-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-(4-quinazolin-4-ylpiperazino)-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C25H34N6O3S MolecularWeight: 498.64086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3CCN(CC3)C4=NC=NC5=CC=CC=C54

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3CCN(CC3)C4=NC=NC5=CC=CC=C54

InChI

InChI=1S/C25H34N6O3S/c1-25(2,3)34-24(33)31-15-18(14-21(31)23(32)30-12-13-35-17-30)28-8-10-29(11-9-28)22-19-6-4-5-7-20(19)26-16-27-22/h4-7,16,18,21H,8-15,17H2,1-3H3