ethyl (2S)-3-(1H-benzimidazol-2-ylmethylimino)-2-cyano-propanoate

Systemtic Name: ethyl (2S)-3-(1H-benzimidazol-2-ylmethylimino)-2-cyano-propanoate Openeye Name: ethyl (2S)-3-(1H-benzimidazol-2-ylmethylimino)-2-cyano-propanoate CAS Name: (2S)-3-(1H-benzimidazol-2-ylmethylimino)-2-cyanopropanoic acid ethyl ester IUPAC Name: ethyl (2S)-3-(1H-benzimidazol-2-ylmethylimino)-2-cyanopropanoate Traditional Name: (2S)-3-(1H-benzimidazol-2-ylmethylimino)-2-cyano-propionic acid ethyl ester Formula: C14H14N4O2 MolecularWeight: 270.28656

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C=NCC1=NC2=CC=CC=C2N1)C#N

Isomeric SMILES

CCOC(=O)[C@@H](C=NCC1=NC2=CC=CC=C2N1)C#N

InChI

InChI=1S/C14H14N4O2/c1-2-20-14(19)10(7-15)8-16-9-13-17-11-5-3-4-6-12(11)18-13/h3-6,8,10H,2,9H2,1H3,(H,17,18)/t10-/m1/s1