diethyl 7-methyl-2-(2-oxidanylidenepropylsulfanyl)indolizine-1,3-dicarboxylate

Systemtic Name: diethyl 7-methyl-2-(2-oxidanylidenepropylsulfanyl)indolizine-1,3-dicarboxylate Openeye Name: diethyl 2-acetonylsulfanyl-7-methyl-indolizine-1,3-dicarboxylate CAS Name: 7-methyl-2-(2-oxopropylthio)indolizine-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 7-methyl-2-(2-oxopropylsulfanyl)indolizine-1,3-dicarboxylate Traditional Name: 2-(acetonylthio)-7-methyl-indolizine-1,3-dicarboxylic acid diethyl ester Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=C(C=CN2C(=C1SCC(=O)C)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)C1=C2C=C(C=CN2C(=C1SCC(=O)C)C(=O)OCC)C

InChI

InChI=1S/C18H21NO5S/c1-5-23-17(21)14-13-9-11(3)7-8-19(13)15(18(22)24-6-2)16(14)25-10-12(4)20/h7-9H,5-6,10H2,1-4H3