[2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl] 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: [2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl] 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: [2-(3-isopropoxypropylamino)-2-oxo-ethyl] 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid [2-oxo-2-(3-propan-2-yloxypropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-propan-2-yloxypropylamino)ethyl] 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-yl)propionic acid [2-(3-isopropoxypropylamino)-2-keto-ethyl] ester Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)COC(=O)CCC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)OCCCNC(=O)COC(=O)CCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C18H24N2O4S/c1-13(2)23-11-5-10-19-16(21)12-24-18(22)9-8-17-20-14-6-3-4-7-15(14)25-17/h3-4,6-7,13H,5,8-12H2,1-2H3,(H,19,21)