methyl (Z)-2-cyano-3-[(4-methoxyphenyl)carbonylamino]-3-methylsulfanyl-prop-2-enoate

Systemtic Name: methyl (Z)-2-cyano-3-[(4-methoxyphenyl)carbonylamino]-3-methylsulfanyl-prop-2-enoate Openeye Name: methyl (Z)-2-cyano-3-[(4-methoxybenzoyl)amino]-3-methylsulfanyl-prop-2-enoate CAS Name: (Z)-2-cyano-3-[[(4-methoxyphenyl)-oxomethyl]amino]-3-(methylthio)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-cyano-3-[(4-methoxybenzoyl)amino]-3-methylsulfanylprop-2-enoate Traditional Name: (Z)-2-cyano-3-(methylthio)-3-(p-anisoylamino)acrylic acid methyl ester Formula: C14H14N2O4S MolecularWeight: 306.33696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O4S/c1-19-10-6-4-9(5-7-10)12(17)16-13(21-3)11(8-15)14(18)20-2/h4-7H,1-3H3,(H,16,17)/b13-11-