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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)(C3=NC=NC4=CC=CC=C43)N5CCNCC5

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)(C3=NC=NC4=CC=CC=C43)N5CCNCC5

InChI

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