ethyl 2-(6-bromanyl-2-methyl-4-phenyl-quinolin-3-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(6-bromanyl-2-methyl-4-phenyl-quinolin-3-yl)sulfanylethanoate Openeye Name: ethyl 2-[(6-bromo-2-methyl-4-phenyl-3-quinolyl)sulfanyl]acetate CAS Name: 2-[(6-bromo-2-methyl-4-phenyl-3-quinolinyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(6-bromo-2-methyl-4-phenylquinolin-3-yl)sulfanylacetate Traditional Name: 2-[(6-bromo-2-methyl-4-phenyl-3-quinolyl)thio]acetic acid ethyl ester Formula: C20H18BrNO2S MolecularWeight: 416.33142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(N=C2C=CC(=CC2=C1C3=CC=CC=C3)Br)C

Isomeric SMILES

CCOC(=O)CSC1=C(N=C2C=CC(=CC2=C1C3=CC=CC=C3)Br)C

InChI

InChI=1S/C20H18BrNO2S/c1-3-24-18(23)12-25-20-13(2)22-17-10-9-15(21)11-16(17)19(20)14-7-5-4-6-8-14/h4-11H,3,12H2,1-2H3