ethyl 1-cyano-2-(3-ethoxy-3-oxidanylidene-propyl)sulfanyl-6,8-dimethyl-indolizine-3-carboxylate

Systemtic Name: ethyl 1-cyano-2-(3-ethoxy-3-oxidanylidene-propyl)sulfanyl-6,8-dimethyl-indolizine-3-carboxylate Openeye Name: ethyl 1-cyano-2-(3-ethoxy-3-oxo-propyl)sulfanyl-6,8-dimethyl-indolizine-3-carboxylate CAS Name: 1-cyano-2-[(3-ethoxy-3-oxopropyl)thio]-6,8-dimethyl-3-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyano-2-(3-ethoxy-3-oxopropyl)sulfanyl-6,8-dimethylindolizine-3-carboxylate Traditional Name: 1-cyano-2-[(3-ethoxy-3-keto-propyl)thio]-6,8-dimethyl-indolizine-3-carboxylic acid ethyl ester Formula: C19H22N2O4S MolecularWeight: 374.45398

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1=C(N2C=C(C=C(C2=C1C#N)C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)CCSC1=C(N2C=C(C=C(C2=C1C#N)C)C)C(=O)OCC

InChI

InChI=1S/C19H22N2O4S/c1-5-24-15(22)7-8-26-18-14(10-20)16-13(4)9-12(3)11-21(16)17(18)19(23)25-6-2/h9,11H,5-8H2,1-4H3