[2-oxidanylidene-2-(propan-2-ylamino)ethyl] 1,3-benzothiazole-6-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylamino)ethyl] 1,3-benzothiazole-6-carboxylate Openeye Name: [2-(isopropylamino)-2-oxo-ethyl] 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [2-oxo-2-(propan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylamino)ethyl] 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [2-(isopropylamino)-2-keto-ethyl] ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)COC(=O)C1=CC2=C(C=C1)N=CS2

Isomeric SMILES

CC(C)NC(=O)COC(=O)C1=CC2=C(C=C1)N=CS2

InChI

InChI=1S/C13H14N2O3S/c1-8(2)15-12(16)6-18-13(17)9-3-4-10-11(5-9)19-7-14-10/h3-5,7-8H,6H2,1-2H3,(H,15,16)