[2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl] 2-quinolin-8-ylsulfanylethanoate

Systemtic Name: [2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl] 2-quinolin-8-ylsulfanylethanoate Openeye Name: [2-(2,4-dimethylphenyl)-2-oxo-ethyl] 2-(8-quinolylsulfanyl)acetate CAS Name: 2-(8-quinolinylthio)acetic acid [2-(2,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethylphenyl)-2-oxoethyl] 2-quinolin-8-ylsulfanylacetate Traditional Name: 2-(8-quinolylthio)acetic acid [2-(2,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C21H19NO3S MolecularWeight: 365.44546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)COC(=O)CSC2=CC=CC3=C2N=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)COC(=O)CSC2=CC=CC3=C2N=CC=C3)C

InChI

InChI=1S/C21H19NO3S/c1-14-8-9-17(15(2)11-14)18(23)12-25-20(24)13-26-19-7-3-5-16-6-4-10-22-21(16)19/h3-11H,12-13H2,1-2H3