tert-butyl 4-[4-[(3-oxidanylidene-1H-2-benzofuran-5-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(3-oxidanylidene-1H-2-benzofuran-5-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(3-oxo-1H-isobenzofuran-5-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[oxo-[(3-oxo-1H-isobenzofuran-5-yl)amino]methyl]-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(3-oxo-1H-2-benzofuran-5-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(3-ketophthalan-5-yl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H25N3O5S MolecularWeight: 443.516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC3=CC4=C(COC4=O)C=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC3=CC4=C(COC4=O)C=C3

InChI

InChI=1S/C22H25N3O5S/c1-22(2,3)30-21(28)25-8-6-13(7-9-25)19-24-17(12-31-19)18(26)23-15-5-4-14-11-29-20(27)16(14)10-15/h4-5,10,12-13H,6-9,11H2,1-3H3,(H,23,26)