ethyl (3S)-2,2-bis(fluoranyl)-3-[(4-methylphenyl)sulfinylamino]-3-phenyl-propanoate

Systemtic Name: ethyl (3S)-2,2-bis(fluoranyl)-3-[(4-methylphenyl)sulfinylamino]-3-phenyl-propanoate Openeye Name: ethyl (3S)-2,2-difluoro-3-phenyl-3-(p-tolylsulfinylamino)propanoate CAS Name: (3S)-2,2-difluoro-3-[(4-methylphenyl)sulfinylamino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (3S)-2,2-difluoro-3-[(4-methylphenyl)sulfinylamino]-3-phenylpropanoate Traditional Name: (3S)-2,2-difluoro-3-phenyl-3-(p-tolylsulfinylamino)propionic acid ethyl ester Formula: C18H19F2NO3S MolecularWeight: 367.410166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CC=C1)NS(=O)C2=CC=C(C=C2)C)(F)F

Isomeric SMILES

CCOC(=O)C([C@H](C1=CC=CC=C1)NS(=O)C2=CC=C(C=C2)C)(F)F

InChI

InChI=1S/C18H19F2NO3S/c1-3-24-17(22)18(19,20)16(14-7-5-4-6-8-14)21-25(23)15-11-9-13(2)10-12-15/h4-12,16,21H,3H2,1-2H3/t16-,25?/m0/s1