ethyl (2E)-2-phenylsulfanyliminopentanoate

Systemtic Name: ethyl (2E)-2-phenylsulfanyliminopentanoate Openeye Name: ethyl (2E)-2-phenylsulfanyliminopentanoate CAS Name: (2E)-2-(phenylthio)iminopentanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-phenylsulfanyliminopentanoate Traditional Name: (2E)-2-(phenylthio)iminovaleric acid ethyl ester Formula: C13H17NO2S MolecularWeight: 251.34458

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NSC1=CC=CC=C1)C(=O)OCC

Isomeric SMILES

CCC/C(=N\SC1=CC=CC=C1)/C(=O)OCC

InChI

InChI=1S/C13H17NO2S/c1-3-8-12(13(15)16-4-2)14-17-11-9-6-5-7-10-11/h5-7,9-10H,3-4,8H2,1-2H3/b14-12+