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

Systemtic Name: tert-butyl 4-[4-(1-phenylindazol-3-yl)piperazin-1-yl]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(1-phenylindazol-3-yl)piperazin-1-yl]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 2-[oxo(3-thiazolidinyl)methyl]-4-[4-(1-phenyl-3-indazolyl)-1-piperazinyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(1-phenylindazol-3-yl)piperazin-1-yl]-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-[4-(1-phenylindazol-3-yl)piperazino]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C30H38N6O3S MolecularWeight: 562.72612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3CCN(CC3)C4=NN(C5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3CCN(CC3)C4=NN(C5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C30H38N6O3S/c1-30(2,3)39-29(38)35-20-23(19-26(35)28(37)34-17-18-40-21-34)32-13-15-33(16-14-32)27-24-11-7-8-12-25(24)36(31-27)22-9-5-4-6-10-22/h4-12,23,26H,13-21H2,1-3H3