ethyl 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-cyano-indolizine-1-carboxylate

Systemtic Name: ethyl 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-3-cyano-indolizine-1-carboxylate Openeye Name: ethyl 2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-3-cyano-indolizine-1-carboxylate CAS Name: 2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-3-cyano-1-indolizinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-3-cyanoindolizine-1-carboxylate Traditional Name: 2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-3-cyano-indolizine-1-carboxylic acid ethyl ester Formula: C20H15ClN2O3S MolecularWeight: 398.8627

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15ClN2O3S/c1-2-26-20(25)18-15-5-3-4-10-23(15)16(11-22)19(18)27-12-17(24)13-6-8-14(21)9-7-13/h3-10H,2,12H2,1H3