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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)(C3=NN(C4=CC=CC=C43)C5=CC=CC=C5)N6CCNCC6

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)(C3=NN(C4=CC=CC=C43)C5=CC=CC=C5)N6CCNCC6

InChI

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