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

Systemtic Name: tert-butyl 4-(1H-indol-2-ylcarbonyl)-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate Openeye Name: tert-butyl 4-(1H-indole-2-carbonyl)-2-(3-pyridyl)isothiazolidine-3-carboxylate CAS Name: 4-[1H-indol-2-yl(oxo)methyl]-2-(3-pyridinyl)-3-isothiazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1H-indole-2-carbonyl)-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate Traditional Name: 4-(1H-indole-2-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=CC4=CC=CC=C4N3

Isomeric SMILES

CC(C)(C)OC(=O)C1C(CSN1C2=CN=CC=C2)C(=O)C3=CC4=CC=CC=C4N3

InChI

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