[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl] 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: [2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl] 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: [2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl] 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid [2-oxo-2-(2-oxolanylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(oxolan-2-ylmethylamino)ethyl] 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-yl)propionic acid [2-keto-2-(tetrahydrofurfurylamino)ethyl] ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)COC(=O)CCC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CC(OC1)CNC(=O)COC(=O)CCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H20N2O4S/c20-15(18-10-12-4-3-9-22-12)11-23-17(21)8-7-16-19-13-5-1-2-6-14(13)24-16/h1-2,5-6,12H,3-4,7-11H2,(H,18,20)