(5-cyano-2-methyl-1-methylsulfanyl-indolizin-3-yl) thiocyanate

Systemtic Name: (5-cyano-2-methyl-1-methylsulfanyl-indolizin-3-yl) thiocyanate Openeye Name: (5-cyano-2-methyl-1-methylsulfanyl-indolizin-3-yl) thiocyanate CAS Name: thiocyanic acid [5-cyano-2-methyl-1-(methylthio)-3-indolizinyl] ester IUPAC Name: (5-cyano-2-methyl-1-methylsulfanylindolizin-3-yl) thiocyanate Traditional Name: thiocyanic acid [5-cyano-2-methyl-1-(methylthio)indolizin-3-yl] ester Formula: C12H9N3S2 MolecularWeight: 259.34996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(=C1SC)C=CC=C2C#N)SC#N

Isomeric SMILES

CC1=C(N2C(=C1SC)C=CC=C2C#N)SC#N

InChI

InChI=1S/C12H9N3S2/c1-8-11(16-2)10-5-3-4-9(6-13)15(10)12(8)17-7-14/h3-5H,1-2H3