(2-chloranyl-6-fluoranyl-phenyl)methyl (2R)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propanoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl (2R)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propanoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl (2R)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propanoate CAS Name: (2R)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenylpropanoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl (2R)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenylpropanoate Traditional Name: (2R)-3-(1,3-benzothiazol-2-yl)-2-methyl-2-phenyl-propionic acid (2-chloro-6-fluoro-benzyl) ester Formula: C24H19ClFNO2S MolecularWeight: 439.929563

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NC2=CC=CC=C2S1)(C3=CC=CC=C3)C(=O)OCC4=C(C=CC=C4Cl)F

Isomeric SMILES

C[C@@](CC1=NC2=CC=CC=C2S1)(C3=CC=CC=C3)C(=O)OCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C24H19ClFNO2S/c1-24(16-8-3-2-4-9-16,14-22-27-20-12-5-6-13-21(20)30-22)23(28)29-15-17-18(25)10-7-11-19(17)26/h2-13H,14-15H2,1H3/t24-/m1/s1