methyl 2-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-[(2-chloro-6-fluorophenyl)methylthio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[2-[(2-chloro-6-fluoro-benzyl)thio]-4-keto-quinazolin-3-yl]acetic acid methyl ester Formula: C18H14ClFN2O3S MolecularWeight: 392.831763

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

COC(=O)CN1C(=O)C2=CC=CC=C2N=C1SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H14ClFN2O3S/c1-25-16(23)9-22-17(24)11-5-2-3-8-15(11)21-18(22)26-10-12-13(19)6-4-7-14(12)20/h2-8H,9-10H2,1H3