methyl 2-(6-fluoranyl-2-phenyl-quinazolin-4-yl)sulfanylethanoate

Systemtic Name: methyl 2-(6-fluoranyl-2-phenyl-quinazolin-4-yl)sulfanylethanoate Openeye Name: methyl 2-(6-fluoro-2-phenyl-quinazolin-4-yl)sulfanylacetate CAS Name: 2-[(6-fluoro-2-phenyl-4-quinazolinyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(6-fluoro-2-phenylquinazolin-4-yl)sulfanylacetate Traditional Name: 2-[(6-fluoro-2-phenyl-quinazolin-4-yl)thio]acetic acid methyl ester Formula: C17H13FN2O2S MolecularWeight: 328.360723

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC(=NC2=C1C=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CSC1=NC(=NC2=C1C=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C17H13FN2O2S/c1-22-15(21)10-23-17-13-9-12(18)7-8-14(13)19-16(20-17)11-5-3-2-4-6-11/h2-9H,10H2,1H3