ethyl 2-(2-cyanoethylsulfanyl)-3-ethanoyl-7-methyl-indolizine-1-carboxylate

Systemtic Name: ethyl 2-(2-cyanoethylsulfanyl)-3-ethanoyl-7-methyl-indolizine-1-carboxylate Openeye Name: ethyl 3-acetyl-2-(2-cyanoethylsulfanyl)-7-methyl-indolizine-1-carboxylate CAS Name: 3-acetyl-2-(2-cyanoethylthio)-7-methyl-1-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-acetyl-2-(2-cyanoethylsulfanyl)-7-methylindolizine-1-carboxylate Traditional Name: 3-acetyl-2-(2-cyanoethylthio)-7-methyl-indolizine-1-carboxylic acid ethyl ester Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O3S/c1-4-22-17(21)14-13-10-11(2)6-8-19(13)15(12(3)20)16(14)23-9-5-7-18/h6,8,10H,4-5,9H2,1-3H3