methyl (E)-2-cyano-3-(1H-indol-3-yl)-3-methylsulfanyl-prop-2-enoate

Systemtic Name: methyl (E)-2-cyano-3-(1H-indol-3-yl)-3-methylsulfanyl-prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-(1H-indol-3-yl)-3-methylsulfanyl-prop-2-enoate CAS Name: (E)-2-cyano-3-(1H-indol-3-yl)-3-(methylthio)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-(1H-indol-3-yl)-3-methylsulfanylprop-2-enoate Traditional Name: (E)-2-cyano-3-(1H-indol-3-yl)-3-(methylthio)acrylic acid methyl ester Formula: C14H12N2O2S MolecularWeight: 272.32228

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C(C1=CNC2=CC=CC=C21)SC)C#N

Isomeric SMILES

COC(=O)/C(=C(\C1=CNC2=CC=CC=C21)/SC)/C#N

InChI

InChI=1S/C14H12N2O2S/c1-18-14(17)10(7-15)13(19-2)11-8-16-12-6-4-3-5-9(11)12/h3-6,8,16H,1-2H3/b13-10+