ethyl (2S)-2-cyano-3-[(1S)-2-methyl-1-thiophen-2-yl-propyl]imino-propanoate

Systemtic Name: ethyl (2S)-2-cyano-3-[(1S)-2-methyl-1-thiophen-2-yl-propyl]imino-propanoate Openeye Name: ethyl (2S)-2-cyano-3-[(1S)-2-methyl-1-(2-thienyl)propyl]imino-propanoate CAS Name: (2S)-2-cyano-3-[(1S)-2-methyl-1-thiophen-2-ylpropyl]iminopropanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-cyano-3-[(1S)-2-methyl-1-thiophen-2-ylpropyl]iminopropanoate Traditional Name: (2S)-2-cyano-3-[(1S)-2-methyl-1-(2-thienyl)propyl]imino-propionic acid ethyl ester Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=NC(C1=CC=CS1)C(C)C)C#N

Isomeric SMILES

CCOC(=O)[C@@H](C=N[C@H](C1=CC=CS1)C(C)C)C#N

InChI

InChI=1S/C14H18N2O2S/c1-4-18-14(17)11(8-15)9-16-13(10(2)3)12-6-5-7-19-12/h5-7,9-11,13H,4H2,1-3H3/t11-,13+/m1/s1