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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C2N1C=CC=C2)C#N)SCC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C(=C2N1C=CC=C2)C#N)SCC(=O)C3=CC=C(C=C3)Cl

InChI

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