tert-butyl 3-[(3-methanoyl-2-pyridin-3-yl-1,2-thiazolidin-4-yl)carbonyl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[(3-methanoyl-2-pyridin-3-yl-1,2-thiazolidin-4-yl)carbonyl]indole-1-carboxylate Openeye Name: tert-butyl 3-[3-formyl-2-(3-pyridyl)isothiazolidine-4-carbonyl]indole-1-carboxylate CAS Name: 3-[[3-formyl-2-(3-pyridinyl)-4-isothiazolidinyl]-oxomethyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(3-formyl-2-pyridin-3-yl-1,2-thiazolidine-4-carbonyl)indole-1-carboxylate Traditional Name: 3-[3-formyl-2-(3-pyridyl)isothiazolidine-4-carbonyl]indole-1-carboxylic acid tert-butyl ester Formula: C23H23N3O4S MolecularWeight: 437.51142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C(=O)C3CSN(C3C=O)C4=CN=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C(=O)C3CSN(C3C=O)C4=CN=CC=C4

InChI

InChI=1S/C23H23N3O4S/c1-23(2,3)30-22(29)25-12-17(16-8-4-5-9-19(16)25)21(28)18-14-31-26(20(18)13-27)15-7-6-10-24-11-15/h4-13,18,20H,14H2,1-3H3