ethyl 2-[3-(phenylmethyl)quinolin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[3-(phenylmethyl)quinolin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[(3-benzyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[[3-(phenylmethyl)-2-quinolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(3-benzylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(3-benzyl-2-quinolyl)thio]acetic acid ethyl ester Formula: C20H19NO2S MolecularWeight: 337.43536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=CC=CC=C2C=C1CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CSC1=NC2=CC=CC=C2C=C1CC3=CC=CC=C3

InChI

InChI=1S/C20H19NO2S/c1-2-23-19(22)14-24-20-17(12-15-8-4-3-5-9-15)13-16-10-6-7-11-18(16)21-20/h3-11,13H,2,12,14H2,1H3