methyl 2-[2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-[(3-fluoro-4-methoxyphenyl)methylthio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[2-[(3-fluoro-4-methoxy-benzyl)thio]-4-keto-quinazolin-3-yl]acetic acid methyl ester Formula: C19H17FN2O4S MolecularWeight: 388.412683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC)F

InChI

InChI=1S/C19H17FN2O4S/c1-25-16-8-7-12(9-14(16)20)11-27-19-21-15-6-4-3-5-13(15)18(24)22(19)10-17(23)26-2/h3-9H,10-11H2,1-2H3