diethyl 2-(2-cyanoethylsulfanyl)indolizine-1,3-dicarboxylate

Systemtic Name: diethyl 2-(2-cyanoethylsulfanyl)indolizine-1,3-dicarboxylate Openeye Name: diethyl 2-(2-cyanoethylsulfanyl)indolizine-1,3-dicarboxylate CAS Name: 2-(2-cyanoethylthio)indolizine-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-(2-cyanoethylsulfanyl)indolizine-1,3-dicarboxylate Traditional Name: 2-(2-cyanoethylthio)indolizine-1,3-dicarboxylic acid diethyl ester Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC=CN2C(=C1SCCC#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C2C=CC=CN2C(=C1SCCC#N)C(=O)OCC

InChI

InChI=1S/C17H18N2O4S/c1-3-22-16(20)13-12-8-5-6-10-19(12)14(17(21)23-4-2)15(13)24-11-7-9-18/h5-6,8,10H,3-4,7,11H2,1-2H3