ethyl (2R)-2-(1,3-benzothiazol-2-ylamino)-2-(ethoxycarbonylamino)-3,3,3-tris(fluoranyl)propanoate

Systemtic Name: ethyl (2R)-2-(1,3-benzothiazol-2-ylamino)-2-(ethoxycarbonylamino)-3,3,3-tris(fluoranyl)propanoate Openeye Name: ethyl (2R)-2-(1,3-benzothiazol-2-ylamino)-2-(ethoxycarbonylamino)-3,3,3-trifluoro-propanoate CAS Name: (2R)-2-(1,3-benzothiazol-2-ylamino)-2-(ethoxycarbonylamino)-3,3,3-trifluoropropanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-(1,3-benzothiazol-2-ylamino)-2-(ethoxycarbonylamino)-3,3,3-trifluoropropanoate Traditional Name: (2R)-2-(1,3-benzothiazol-2-ylamino)-2-(carbethoxyamino)-3,3,3-trifluoro-propionic acid ethyl ester Formula: C15H16F3N3O4S MolecularWeight: 391.36545

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(F)(F)F)(NC1=NC2=CC=CC=C2S1)NC(=O)OCC

Isomeric SMILES

CCOC(=O)[C@](C(F)(F)F)(NC1=NC2=CC=CC=C2S1)NC(=O)OCC

InChI

InChI=1S/C15H16F3N3O4S/c1-3-24-11(22)14(15(16,17)18,21-13(23)25-4-2)20-12-19-9-7-5-6-8-10(9)26-12/h5-8H,3-4H2,1-2H3,(H,19,20)(H,21,23)/t14-/m0/s1