ethyl 1-cyano-2-(3-ethoxy-3-oxidanylidene-propyl)sulfanyl-indolizine-3-carboxylate

Systemtic Name: ethyl 1-cyano-2-(3-ethoxy-3-oxidanylidene-propyl)sulfanyl-indolizine-3-carboxylate Openeye Name: ethyl 1-cyano-2-(3-ethoxy-3-oxo-propyl)sulfanyl-indolizine-3-carboxylate CAS Name: 1-cyano-2-[(3-ethoxy-3-oxopropyl)thio]-3-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyano-2-(3-ethoxy-3-oxopropyl)sulfanylindolizine-3-carboxylate Traditional Name: 1-cyano-2-[(3-ethoxy-3-keto-propyl)thio]indolizine-3-carboxylic acid ethyl ester Formula: C17H18N2O4S MolecularWeight: 346.40082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1=C(N2C=CC=CC2=C1C#N)C(=O)OCC

Isomeric SMILES

CCOC(=O)CCSC1=C(N2C=CC=CC2=C1C#N)C(=O)OCC

InChI

InChI=1S/C17H18N2O4S/c1-3-22-14(20)8-10-24-16-12(11-18)13-7-5-6-9-19(13)15(16)17(21)23-4-2/h5-7,9H,3-4,8,10H2,1-2H3