tert-butyl 4-(1H-indol-3-ylcarbonyl)-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate

Systemtic Name: tert-butyl 4-(1H-indol-3-ylcarbonyl)-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate Openeye Name: tert-butyl 4-(1H-indole-3-carbonyl)-2-(3-pyridyl)isothiazolidine-3-carboxylate CAS Name: 4-[1H-indol-3-yl(oxo)methyl]-2-(3-pyridinyl)-3-isothiazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1H-indole-3-carbonyl)-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate Traditional Name: 4-(1H-indole-3-carbonyl)-2-(3-pyridyl)isothiazolidine-3-carboxylic acid tert-butyl ester Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1C(CSN1C2=CN=CC=C2)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)OC(=O)C1C(CSN1C2=CN=CC=C2)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H23N3O3S/c1-22(2,3)28-21(27)19-17(13-29-25(19)14-7-6-10-23-11-14)20(26)16-12-24-18-9-5-4-8-15(16)18/h4-12,17,19,24H,13H2,1-3H3