methyl (E)-2-cyano-3-[(4-methoxyphenyl)amino]-3-methylsulfanyl-prop-2-enoate

Systemtic Name: methyl (E)-2-cyano-3-[(4-methoxyphenyl)amino]-3-methylsulfanyl-prop-2-enoate Openeye Name: methyl (E)-2-cyano-3-(4-methoxyanilino)-3-methylsulfanyl-prop-2-enoate CAS Name: (E)-2-cyano-3-(4-methoxyanilino)-3-(methylthio)-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-cyano-3-(4-methoxyanilino)-3-methylsulfanylprop-2-enoate Traditional Name: (E)-2-cyano-3-(methylthio)-3-(p-anisidino)acrylic acid methyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=C(C#N)C(=O)OC)SC

Isomeric SMILES

COC1=CC=C(C=C1)N/C(=C(/C#N)\C(=O)OC)/SC

InChI

InChI=1S/C13H14N2O3S/c1-17-10-6-4-9(5-7-10)15-12(19-3)11(8-14)13(16)18-2/h4-7,15H,1-3H3/b12-11+