[2-(methylamino)-2-oxidanylidene-ethyl] 4-(1,3-benzothiazol-2-yl)butanoate

Systemtic Name: [2-(methylamino)-2-oxidanylidene-ethyl] 4-(1,3-benzothiazol-2-yl)butanoate Openeye Name: [2-(methylamino)-2-oxo-ethyl] 4-(1,3-benzothiazol-2-yl)butanoate CAS Name: 4-(1,3-benzothiazol-2-yl)butanoic acid [2-(methylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylamino)-2-oxoethyl] 4-(1,3-benzothiazol-2-yl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-yl)butyric acid [2-keto-2-(methylamino)ethyl] ester Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)COC(=O)CCCC1=NC2=CC=CC=C2S1

Isomeric SMILES

CNC(=O)COC(=O)CCCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C14H16N2O3S/c1-15-12(17)9-19-14(18)8-4-7-13-16-10-5-2-3-6-11(10)20-13/h2-3,5-6H,4,7-9H2,1H3,(H,15,17)