(2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 2,5-dimethylfuran-3-carboxylate

Systemtic Name: (2-chloranyl-7-methylsulfanyl-quinolin-3-yl)methyl 2,5-dimethylfuran-3-carboxylate Openeye Name: (2-chloro-7-methylsulfanyl-3-quinolyl)methyl 2,5-dimethylfuran-3-carboxylate CAS Name: 2,5-dimethyl-3-furancarboxylic acid [2-chloro-7-(methylthio)-3-quinolinyl]methyl ester IUPAC Name: (2-chloro-7-methylsulfanylquinolin-3-yl)methyl 2,5-dimethylfuran-3-carboxylate Traditional Name: 2,5-dimethylfuran-3-carboxylic acid [2-chloro-7-(methylthio)-3-quinolyl]methyl ester Formula: C18H16ClNO3S MolecularWeight: 361.84254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)OCC2=C(N=C3C=C(C=CC3=C2)SC)Cl

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)OCC2=C(N=C3C=C(C=CC3=C2)SC)Cl

InChI

InChI=1S/C18H16ClNO3S/c1-10-6-15(11(2)23-10)18(21)22-9-13-7-12-4-5-14(24-3)8-16(12)20-17(13)19/h4-8H,9H2,1-3H3