ethyl 4-[(4-methylquinolin-2-yl)sulfanylmethyl]benzoate

Systemtic Name: ethyl 4-[(4-methylquinolin-2-yl)sulfanylmethyl]benzoate Openeye Name: ethyl 4-[(4-methyl-2-quinolyl)sulfanylmethyl]benzoate CAS Name: 4-[[(4-methyl-2-quinolinyl)thio]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-methylquinolin-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4-methyl-2-quinolyl)thio]methyl]benzoic acid ethyl ester Formula: C20H19NO2S MolecularWeight: 337.43536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=C2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C(=C2)C

InChI

InChI=1S/C20H19NO2S/c1-3-23-20(22)16-10-8-15(9-11-16)13-24-19-12-14(2)17-6-4-5-7-18(17)21-19/h4-12H,3,13H2,1-2H3