ethyl 3-(1-cyano-2-methylsulfanyl-indolizin-3-yl)prop-2-ynoate

Systemtic Name: ethyl 3-(1-cyano-2-methylsulfanyl-indolizin-3-yl)prop-2-ynoate Openeye Name: ethyl 3-(1-cyano-2-methylsulfanyl-indolizin-3-yl)prop-2-ynoate CAS Name: 3-[1-cyano-2-(methylthio)-3-indolizinyl]-2-propynoic acid ethyl ester IUPAC Name: ethyl 3-(1-cyano-2-methylsulfanylindolizin-3-yl)prop-2-ynoate Traditional Name: 3-[1-cyano-2-(methylthio)indolizin-3-yl]propiolic acid ethyl ester Formula: C15H12N2O2S MolecularWeight: 284.33298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12N2O2S/c1-3-19-14(18)8-7-13-15(20-2)11(10-16)12-6-4-5-9-17(12)13/h4-6,9H,3H2,1-2H3