ethyl 3-cyano-6,8-dimethyl-2-(2-oxidanylidenepropylsulfanyl)indolizine-1-carboxylate

Systemtic Name: ethyl 3-cyano-6,8-dimethyl-2-(2-oxidanylidenepropylsulfanyl)indolizine-1-carboxylate Openeye Name: ethyl 2-acetonylsulfanyl-3-cyano-6,8-dimethyl-indolizine-1-carboxylate CAS Name: 3-cyano-6,8-dimethyl-2-(2-oxopropylthio)-1-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-6,8-dimethyl-2-(2-oxopropylsulfanyl)indolizine-1-carboxylate Traditional Name: 2-(acetonylthio)-3-cyano-6,8-dimethyl-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(=CC(=CN2C(=C1SCC(=O)C)C#N)C)C

Isomeric SMILES

CCOC(=O)C1=C2C(=CC(=CN2C(=C1SCC(=O)C)C#N)C)C

InChI

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