ethyl (2S)-3-[2-(4-chlorophenyl)sulfanylethylimino]-2-cyano-propanoate

Systemtic Name: ethyl (2S)-3-[2-(4-chlorophenyl)sulfanylethylimino]-2-cyano-propanoate Openeye Name: ethyl (2S)-3-[2-(4-chlorophenyl)sulfanylethylimino]-2-cyano-propanoate CAS Name: (2S)-3-[2-[(4-chlorophenyl)thio]ethylimino]-2-cyanopropanoic acid ethyl ester IUPAC Name: ethyl (2S)-3-[2-(4-chlorophenyl)sulfanylethylimino]-2-cyanopropanoate Traditional Name: (2S)-3-[2-[(4-chlorophenyl)thio]ethylimino]-2-cyano-propionic acid ethyl ester Formula: C14H15ClN2O2S MolecularWeight: 310.7991

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=NCCSC1=CC=C(C=C1)Cl)C#N

Isomeric SMILES

CCOC(=O)[C@@H](C=NCCSC1=CC=C(C=C1)Cl)C#N

InChI

InChI=1S/C14H15ClN2O2S/c1-2-19-14(18)11(9-16)10-17-7-8-20-13-5-3-12(15)4-6-13/h3-6,10-11H,2,7-8H2,1H3/t11-/m1/s1