tert-butyl 4-[1-(2-ethoxy-2-oxidanylidene-ethyl)indol-3-yl]carbonyl-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate

Systemtic Name: tert-butyl 4-[1-(2-ethoxy-2-oxidanylidene-ethyl)indol-3-yl]carbonyl-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate Openeye Name: tert-butyl 4-[1-(2-ethoxy-2-oxo-ethyl)indole-3-carbonyl]-2-(3-pyridyl)isothiazolidine-3-carboxylate CAS Name: 4-[[1-(2-ethoxy-2-oxoethyl)-3-indolyl]-oxomethyl]-2-(3-pyridinyl)-3-isothiazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(2-ethoxy-2-oxoethyl)indole-3-carbonyl]-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate Traditional Name: 4-[1-(2-ethoxy-2-keto-ethyl)indole-3-carbonyl]-2-(3-pyridyl)isothiazolidine-3-carboxylic acid tert-butyl ester Formula: C26H29N3O5S MolecularWeight: 495.59056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=C(C2=CC=CC=C21)C(=O)C3CSN(C3C(=O)OC(C)(C)C)C4=CN=CC=C4

Isomeric SMILES

CCOC(=O)CN1C=C(C2=CC=CC=C21)C(=O)C3CSN(C3C(=O)OC(C)(C)C)C4=CN=CC=C4

InChI

InChI=1S/C26H29N3O5S/c1-5-33-22(30)15-28-14-19(18-10-6-7-11-21(18)28)24(31)20-16-35-29(17-9-8-12-27-13-17)23(20)25(32)34-26(2,3)4/h6-14,20,23H,5,15-16H2,1-4H3