N-[(1S,2S)-1-cyano-2-fluoranyl-2-phenyl-ethyl]-4-methyl-benzenesulfinamide

Systemtic Name: N-[(1S,2S)-1-cyano-2-fluoranyl-2-phenyl-ethyl]-4-methyl-benzenesulfinamide Openeye Name: N-[(1S,2S)-1-cyano-2-fluoro-2-phenyl-ethyl]-4-methyl-benzenesulfinamide CAS Name: N-[(1S,2S)-1-cyano-2-fluoro-2-phenylethyl]-4-methylbenzenesulfinamide IUPAC Name: N-[(1S,2S)-1-cyano-2-fluoro-2-phenylethyl]-4-methylbenzenesulfinamide Traditional Name: N-[(1S,2S)-1-cyano-2-fluoro-2-phenyl-ethyl]-4-methyl-benzenesulfinamide Formula: C16H15FN2OS MolecularWeight: 302.366503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)NC(C#N)C(C2=CC=CC=C2)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)N[C@@H](C#N)[C@H](C2=CC=CC=C2)F

InChI

InChI=1S/C16H15FN2OS/c1-12-7-9-14(10-8-12)21(20)19-15(11-18)16(17)13-5-3-2-4-6-13/h2-10,15-16,19H,1H3/t15-,16-,21?/m0/s1