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

Systemtic Name: methyl (Z)-2-cyano-3-[(4-methylphenyl)carbonylamino]-3-methylsulfanyl-prop-2-enoate Openeye Name: methyl (Z)-2-cyano-3-[(4-methylbenzoyl)amino]-3-methylsulfanyl-prop-2-enoate CAS Name: (Z)-2-cyano-3-[[(4-methylphenyl)-oxomethyl]amino]-3-(methylthio)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-cyano-3-[(4-methylbenzoyl)amino]-3-methylsulfanylprop-2-enoate Traditional Name: (Z)-2-cyano-3-(methylthio)-3-(p-toluoylamino)acrylic acid methyl ester Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=C(C#N)C(=O)OC)SC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C(\C#N)/C(=O)OC)/SC

InChI

InChI=1S/C14H14N2O3S/c1-9-4-6-10(7-5-9)12(17)16-13(20-3)11(8-15)14(18)19-2/h4-7H,1-3H3,(H,16,17)/b13-11-