ethyl (E)-3-(1-cyano-6,8-dimethyl-2-methylsulfanyl-indolizin-3-yl)prop-2-enoate

Systemtic Name: ethyl (E)-3-(1-cyano-6,8-dimethyl-2-methylsulfanyl-indolizin-3-yl)prop-2-enoate Openeye Name: ethyl (E)-3-(1-cyano-6,8-dimethyl-2-methylsulfanyl-indolizin-3-yl)prop-2-enoate CAS Name: (E)-3-[1-cyano-6,8-dimethyl-2-(methylthio)-3-indolizinyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(1-cyano-6,8-dimethyl-2-methylsulfanylindolizin-3-yl)prop-2-enoate Traditional Name: (E)-3-[1-cyano-6,8-dimethyl-2-(methylthio)indolizin-3-yl]acrylic acid ethyl ester Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(C(=C2N1C=C(C=C2C)C)C#N)SC

Isomeric SMILES

CCOC(=O)/C=C/C1=C(C(=C2N1C=C(C=C2C)C)C#N)SC

InChI

InChI=1S/C17H18N2O2S/c1-5-21-15(20)7-6-14-17(22-4)13(9-18)16-12(3)8-11(2)10-19(14)16/h6-8,10H,5H2,1-4H3/b7-6+