ethyl 3-[(4-methylquinolin-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[(4-methylquinolin-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[(4-methyl-2-quinolyl)sulfanylmethyl]benzofuran-2-carboxylate CAS Name: 3-[[(4-methyl-2-quinolinyl)thio]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(4-methylquinolin-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[(4-methyl-2-quinolyl)thio]methyl]coumarilic acid ethyl ester Formula: C22H19NO3S MolecularWeight: 377.45616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NC4=CC=CC=C4C(=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)CSC3=NC4=CC=CC=C4C(=C3)C

InChI

InChI=1S/C22H19NO3S/c1-3-25-22(24)21-17(16-9-5-7-11-19(16)26-21)13-27-20-12-14(2)15-8-4-6-10-18(15)23-20/h4-12H,3,13H2,1-2H3