tert-butyl 4-[[2-(1-methoxy-1-oxidanylidene-propan-2-yl)-1H-indol-3-yl]carbonyl]-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate

Systemtic Name: tert-butyl 4-[[2-(1-methoxy-1-oxidanylidene-propan-2-yl)-1H-indol-3-yl]carbonyl]-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate Openeye Name: tert-butyl 4-[2-(2-methoxy-1-methyl-2-oxo-ethyl)-1H-indole-3-carbonyl]-2-(3-pyridyl)isothiazolidine-3-carboxylate CAS Name: 4-[[2-(1-methoxy-1-oxopropan-2-yl)-1H-indol-3-yl]-oxomethyl]-2-(3-pyridinyl)-3-isothiazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(1-methoxy-1-oxopropan-2-yl)-1H-indole-3-carbonyl]-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate Traditional Name: 4-[2-(2-keto-2-methoxy-1-methyl-ethyl)-1H-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:

CC(C1=C(C2=CC=CC=C2N1)C(=O)C3CSN(C3C(=O)OC(C)(C)C)C4=CN=CC=C4)C(=O)OC

Isomeric SMILES

CC(C1=C(C2=CC=CC=C2N1)C(=O)C3CSN(C3C(=O)OC(C)(C)C)C4=CN=CC=C4)C(=O)OC

InChI

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