ethyl 1-cyano-2-(2-cyanoethylsulfanyl)indolizine-3-carboxylate

Systemtic Name: ethyl 1-cyano-2-(2-cyanoethylsulfanyl)indolizine-3-carboxylate Openeye Name: ethyl 1-cyano-2-(2-cyanoethylsulfanyl)indolizine-3-carboxylate CAS Name: 1-cyano-2-(2-cyanoethylthio)-3-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyano-2-(2-cyanoethylsulfanyl)indolizine-3-carboxylate Traditional Name: 1-cyano-2-(2-cyanoethylthio)indolizine-3-carboxylic acid ethyl ester Formula: C15H13N3O2S MolecularWeight: 299.34762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N3O2S/c1-2-20-15(19)13-14(21-9-5-7-16)11(10-17)12-6-3-4-8-18(12)13/h3-4,6,8H,2,5,9H2,1H3