ethyl (E)-2-cyano-3-(ethylamino)-3-methylsulfanyl-prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-(ethylamino)-3-methylsulfanyl-prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-(ethylamino)-3-methylsulfanyl-prop-2-enoate CAS Name: (E)-2-cyano-3-(ethylamino)-3-(methylthio)-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-(ethylamino)-3-methylsulfanylprop-2-enoate Traditional Name: (E)-2-cyano-3-(ethylamino)-3-(methylthio)acrylic acid ethyl ester Formula: C9H14N2O2S MolecularWeight: 214.28466

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=C(C#N)C(=O)OCC)SC

Isomeric SMILES

CCN/C(=C(/C#N)\C(=O)OCC)/SC

InChI

InChI=1S/C9H14N2O2S/c1-4-11-8(14-3)7(6-10)9(12)13-5-2/h11H,4-5H2,1-3H3/b8-7+