(4-phenylphenyl)methyl 2-(4-methylquinolin-2-yl)sulfanylethanoate

Systemtic Name: (4-phenylphenyl)methyl 2-(4-methylquinolin-2-yl)sulfanylethanoate Openeye Name: (4-phenylphenyl)methyl 2-[(4-methyl-2-quinolyl)sulfanyl]acetate CAS Name: 2-[(4-methyl-2-quinolinyl)thio]acetic acid (4-phenylphenyl)methyl ester IUPAC Name: (4-phenylphenyl)methyl 2-(4-methylquinolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-methyl-2-quinolyl)thio]acetic acid (4-phenylbenzyl) ester Formula: C25H21NO2S MolecularWeight: 399.50474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)OCC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)OCC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H21NO2S/c1-18-15-24(26-23-10-6-5-9-22(18)23)29-17-25(27)28-16-19-11-13-21(14-12-19)20-7-3-2-4-8-20/h2-15H,16-17H2,1H3