methyl (Z)-2-cyano-3-methylsulfanyl-3-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoate

Systemtic Name: methyl (Z)-2-cyano-3-methylsulfanyl-3-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoate Openeye Name: methyl (Z)-2-cyano-3-methylsulfanyl-3-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoate CAS Name: (Z)-2-cyano-3-(methylthio)-3-[[(E)-1-oxo-3-phenylprop-2-enyl]amino]-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-cyano-3-methylsulfanyl-3-[[(E)-3-phenylprop-2-enoyl]amino]prop-2-enoate Traditional Name: (Z)-2-cyano-3-(methylthio)-3-[[(E)-3-phenylacryloyl]amino]acrylic acid methyl ester Formula: C15H14N2O3S MolecularWeight: 302.34826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O3S/c1-20-15(19)12(10-16)14(21-2)17-13(18)9-8-11-6-4-3-5-7-11/h3-9H,1-2H3,(H,17,18)/b9-8+,14-12-