ethyl 1-methylsulfanyl-3-thiocyanato-indolizine-2-carboxylate

Systemtic Name: ethyl 1-methylsulfanyl-3-thiocyanato-indolizine-2-carboxylate Openeye Name: ethyl 1-methylsulfanyl-3-thiocyanato-indolizine-2-carboxylate CAS Name: 1-(methylthio)-3-thiocyanato-2-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methylsulfanyl-3-thiocyanatoindolizine-2-carboxylate Traditional Name: 1-(methylthio)-3-thiocyanato-indolizine-2-carboxylic acid ethyl ester Formula: C13H12N2O2S2 MolecularWeight: 292.37658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N2C=CC=CC2=C1SC)SC#N

Isomeric SMILES

CCOC(=O)C1=C(N2C=CC=CC2=C1SC)SC#N

InChI

InChI=1S/C13H12N2O2S2/c1-3-17-13(16)10-11(18-2)9-6-4-5-7-15(9)12(10)19-8-14/h4-7H,3H2,1-2H3