ethyl 3-cyano-6,8-dimethyl-2-phenacylsulfanyl-indolizine-1-carboxylate

Systemtic Name: ethyl 3-cyano-6,8-dimethyl-2-phenacylsulfanyl-indolizine-1-carboxylate Openeye Name: ethyl 3-cyano-6,8-dimethyl-2-phenacylsulfanyl-indolizine-1-carboxylate CAS Name: 3-cyano-6,8-dimethyl-2-(phenacylthio)-1-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-6,8-dimethyl-2-phenacylsulfanylindolizine-1-carboxylate Traditional Name: 3-cyano-6,8-dimethyl-2-(phenacylthio)indolizine-1-carboxylic acid ethyl ester Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=CC(=CN2C(=C1SCC(=O)C3=CC=CC=C3)C#N)C)C

Isomeric SMILES

CCOC(=O)C1=C2C(=CC(=CN2C(=C1SCC(=O)C3=CC=CC=C3)C#N)C)C

InChI

InChI=1S/C22H20N2O3S/c1-4-27-22(26)19-20-15(3)10-14(2)12-24(20)17(11-23)21(19)28-13-18(25)16-8-6-5-7-9-16/h5-10,12H,4,13H2,1-3H3