2-phenoxyethyl 2-(4,8-dimethylquinolin-2-yl)sulfanylethanoate

Systemtic Name: 2-phenoxyethyl 2-(4,8-dimethylquinolin-2-yl)sulfanylethanoate Openeye Name: 2-phenoxyethyl 2-[(4,8-dimethyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(4,8-dimethyl-2-quinolinyl)thio]acetic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 2-(4,8-dimethylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(4,8-dimethyl-2-quinolyl)thio]acetic acid 2-phenoxyethyl ester Formula: C21H21NO3S MolecularWeight: 367.46134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)OCCOC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC(=O)OCCOC3=CC=CC=C3

InChI

InChI=1S/C21H21NO3S/c1-15-7-6-10-18-16(2)13-19(22-21(15)18)26-14-20(23)25-12-11-24-17-8-4-3-5-9-17/h3-10,13H,11-12,14H2,1-2H3