ethyl 2-(2-cyanoethylsulfanyl)-3-ethanoyl-6,8-dimethyl-indolizine-1-carboxylate

Systemtic Name: ethyl 2-(2-cyanoethylsulfanyl)-3-ethanoyl-6,8-dimethyl-indolizine-1-carboxylate Openeye Name: ethyl 3-acetyl-2-(2-cyanoethylsulfanyl)-6,8-dimethyl-indolizine-1-carboxylate CAS Name: 3-acetyl-2-(2-cyanoethylthio)-6,8-dimethyl-1-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-acetyl-2-(2-cyanoethylsulfanyl)-6,8-dimethylindolizine-1-carboxylate Traditional Name: 3-acetyl-2-(2-cyanoethylthio)-6,8-dimethyl-indolizine-1-carboxylic acid ethyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3S/c1-5-23-18(22)14-15-12(3)9-11(2)10-20(15)16(13(4)21)17(14)24-8-6-7-19/h9-10H,5-6,8H2,1-4H3