methyl 2-methyl-5-[(4-methylquinolin-2-yl)sulfanylmethyl]furan-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[(4-methylquinolin-2-yl)sulfanylmethyl]furan-3-carboxylate Openeye Name: methyl 2-methyl-5-[(4-methyl-2-quinolyl)sulfanylmethyl]furan-3-carboxylate CAS Name: 2-methyl-5-[[(4-methyl-2-quinolinyl)thio]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[(4-methylquinolin-2-yl)sulfanylmethyl]furan-3-carboxylate Traditional Name: 2-methyl-5-[[(4-methyl-2-quinolyl)thio]methyl]furan-3-carboxylic acid methyl ester Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC3=CC(=C(O3)C)C(=O)OC

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC3=CC(=C(O3)C)C(=O)OC

InChI

InChI=1S/C18H17NO3S/c1-11-8-17(19-16-7-5-4-6-14(11)16)23-10-13-9-15(12(2)22-13)18(20)21-3/h4-9H,10H2,1-3H3