ethyl 3-(benzimidazol-1-yl)-2-cyano-3-methylsulfanyl-prop-2-enoate

Systemtic Name: ethyl 3-(benzimidazol-1-yl)-2-cyano-3-methylsulfanyl-prop-2-enoate Openeye Name: ethyl 3-(benzimidazol-1-yl)-2-cyano-3-methylsulfanyl-prop-2-enoate CAS Name: 3-(1-benzimidazolyl)-2-cyano-3-(methylthio)-2-propenoic acid ethyl ester IUPAC Name: ethyl 3-(benzimidazol-1-yl)-2-cyano-3-methylsulfanylprop-2-enoate Traditional Name: 3-(benzimidazol-1-yl)-2-cyano-3-(methylthio)acrylic acid ethyl ester Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(N1C=NC2=CC=CC=C21)SC)C#N

Isomeric SMILES

CCOC(=O)C(=C(N1C=NC2=CC=CC=C21)SC)C#N

InChI

InChI=1S/C14H13N3O2S/c1-3-19-14(18)10(8-15)13(20-2)17-9-16-11-6-4-5-7-12(11)17/h4-7,9H,3H2,1-2H3