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

Systemtic Name: methyl 3-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]propanoate Openeye Name: methyl 3-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]propanoate CAS Name: 3-[2-[(2-chloro-6-fluorophenyl)methylthio]-4-oxo-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]propanoate Traditional Name: 3-[2-[(2-chloro-6-fluoro-benzyl)thio]-4-keto-quinazolin-3-yl]propionic acid methyl ester Formula: C19H16ClFN2O3S MolecularWeight: 406.858343

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(C=CC=C3Cl)F

Isomeric SMILES

COC(=O)CCN1C(=O)C2=CC=CC=C2N=C1SCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C19H16ClFN2O3S/c1-26-17(24)9-10-23-18(25)12-5-2-3-8-16(12)22-19(23)27-11-13-14(20)6-4-7-15(13)21/h2-8H,9-11H2,1H3