ethyl 2-[6-bromanyl-3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[6-bromanyl-3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[6-bromo-3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[6-bromo-3-(4-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-bromo-3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[6-bromo-4-keto-3-(4-methoxyphenyl)quinazolin-2-yl]thio]acetic acid ethyl ester Formula: C19H17BrN2O4S MolecularWeight: 449.31828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=C(C=C(C=C2)Br)C(=O)N1C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)CSC1=NC2=C(C=C(C=C2)Br)C(=O)N1C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H17BrN2O4S/c1-3-26-17(23)11-27-19-21-16-9-4-12(20)10-15(16)18(24)22(19)13-5-7-14(25-2)8-6-13/h4-10H,3,11H2,1-2H3