ethyl (E)-3-(1-cyano-2-ethylsulfanyl-indolizin-3-yl)prop-2-enoate

Systemtic Name: ethyl (E)-3-(1-cyano-2-ethylsulfanyl-indolizin-3-yl)prop-2-enoate Openeye Name: ethyl (E)-3-(1-cyano-2-ethylsulfanyl-indolizin-3-yl)prop-2-enoate CAS Name: (E)-3-[1-cyano-2-(ethylthio)-3-indolizinyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-(1-cyano-2-ethylsulfanylindolizin-3-yl)prop-2-enoate Traditional Name: (E)-3-[1-cyano-2-(ethylthio)indolizin-3-yl]acrylic acid ethyl ester Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=C(C(=C2N1C=CC=C2)C#N)SCC

Isomeric SMILES

CCOC(=O)/C=C/C1=C(C(=C2N1C=CC=C2)C#N)SCC

InChI

InChI=1S/C16H16N2O2S/c1-3-20-15(19)9-8-14-16(21-4-2)12(11-17)13-7-5-6-10-18(13)14/h5-10H,3-4H2,1-2H3/b9-8+