[(2R)-1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate

Systemtic Name: [(2R)-1-(2,3-dihydroindol-1-yl)-1-oxidanylidene-propan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate Openeye Name: [(1R)-2-indolin-1-yl-1-methyl-2-oxo-ethyl] 3-(1,3-benzothiazol-2-yl)propanoate CAS Name: 3-(1,3-benzothiazol-2-yl)propanoic acid [(2R)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl] 3-(1,3-benzothiazol-2-yl)propanoate Traditional Name: 3-(1,3-benzothiazol-2-yl)propionic acid [(1R)-2-indolin-1-yl-2-keto-1-methyl-ethyl] ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)OC(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C[C@H](C(=O)N1CCC2=CC=CC=C21)OC(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N2O3S/c1-14(21(25)23-13-12-15-6-2-4-8-17(15)23)26-20(24)11-10-19-22-16-7-3-5-9-18(16)27-19/h2-9,14H,10-13H2,1H3/t14-/m1/s1