methyl 2-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: methyl 2-[6-bromo-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanylacetate CAS Name: 2-[[6-bromo-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[6-bromo-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[[6-bromo-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]acetic acid methyl ester Formula: C14H15BrN2O4S MolecularWeight: 387.2489

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)OC

Isomeric SMILES

COCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)OC

InChI

InChI=1S/C14H15BrN2O4S/c1-20-6-5-17-13(19)10-7-9(15)3-4-11(10)16-14(17)22-8-12(18)21-2/h3-4,7H,5-6,8H2,1-2H3