tert-butyl 4-[(6-phenylmethoxy-1H-indol-3-yl)carbonyl]-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate

Systemtic Name: tert-butyl 4-[(6-phenylmethoxy-1H-indol-3-yl)carbonyl]-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate Openeye Name: tert-butyl 4-(6-benzyloxy-1H-indole-3-carbonyl)-2-(3-pyridyl)isothiazolidine-3-carboxylate CAS Name: 4-[oxo-(6-phenylmethoxy-1H-indol-3-yl)methyl]-2-(3-pyridinyl)-3-isothiazolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-phenylmethoxy-1H-indole-3-carbonyl)-2-pyridin-3-yl-1,2-thiazolidine-3-carboxylate Traditional Name: 4-(6-benzoxy-1H-indole-3-carbonyl)-2-(3-pyridyl)isothiazolidine-3-carboxylic acid tert-butyl ester Formula: C29H29N3O4S MolecularWeight: 515.62326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1C(CSN1C2=CN=CC=C2)C(=O)C3=CNC4=C3C=CC(=C4)OCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)C1C(CSN1C2=CN=CC=C2)C(=O)C3=CNC4=C3C=CC(=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C29H29N3O4S/c1-29(2,3)36-28(34)26-24(18-37-32(26)20-10-7-13-30-15-20)27(33)23-16-31-25-14-21(11-12-22(23)25)35-17-19-8-5-4-6-9-19/h4-16,24,26,31H,17-18H2,1-3H3