tert-butyl 4-[4-(5-fluoranyl-1-methyl-benzimidazol-2-yl)piperazin-1-yl]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(5-fluoranyl-1-methyl-benzimidazol-2-yl)piperazin-1-yl]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(5-fluoro-1-methyl-benzimidazol-2-yl)piperazin-1-yl]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-[4-(5-fluoro-1-methyl-2-benzimidazolyl)-1-piperazinyl]-2-[oxo(3-thiazolidinyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(5-fluoro-1-methylbenzimidazol-2-yl)piperazin-1-yl]-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-[4-(5-fluoro-1-methyl-benzimidazol-2-yl)piperazino]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C25H35FN6O3S MolecularWeight: 518.647203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3CCN(CC3)C4=NC5=C(N4C)C=CC(=C5)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3CCN(CC3)C4=NC5=C(N4C)C=CC(=C5)F

InChI

InChI=1S/C25H35FN6O3S/c1-25(2,3)35-24(34)32-15-18(14-21(32)22(33)31-11-12-36-16-31)29-7-9-30(10-8-29)23-27-19-13-17(26)5-6-20(19)28(23)4/h5-6,13,18,21H,7-12,14-16H2,1-4H3