(1-cyanoindolizin-2-yl)methyl 3-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 3-(4-chlorophenyl)sulfanylpropanoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 3-(4-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(4-chlorophenyl)thio]propanoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 3-(4-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-chlorophenyl)thio]propionic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C19H15ClN2O2S MolecularWeight: 370.8526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=CN2C=C1)COC(=O)CCSC3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1=CC2=C(C(=CN2C=C1)COC(=O)CCSC3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C19H15ClN2O2S/c20-15-4-6-16(7-5-15)25-10-8-19(23)24-13-14-12-22-9-2-1-3-18(22)17(14)11-21/h1-7,9,12H,8,10,13H2