methyl 2-[[6,8-bis(bromanyl)-4-oxidanylidene-1H-quinazolin-2-yl]methylsulfanyl]ethanoate

Systemtic Name: methyl 2-[[6,8-bis(bromanyl)-4-oxidanylidene-1H-quinazolin-2-yl]methylsulfanyl]ethanoate Openeye Name: methyl 2-[(6,8-dibromo-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]acetate CAS Name: 2-[(6,8-dibromo-4-oxo-1H-quinazolin-2-yl)methylthio]acetic acid methyl ester IUPAC Name: methyl 2-[(6,8-dibromo-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(6,8-dibromo-4-keto-1H-quinazolin-2-yl)methylthio]acetic acid methyl ester Formula: C12H10Br2N2O3S MolecularWeight: 422.0924

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCC1=NC(=O)C2=CC(=CC(=C2N1)Br)Br

Isomeric SMILES

COC(=O)CSCC1=NC(=O)C2=CC(=CC(=C2N1)Br)Br

InChI

InChI=1S/C12H10Br2N2O3S/c1-19-10(17)5-20-4-9-15-11-7(12(18)16-9)2-6(13)3-8(11)14/h2-3H,4-5H2,1H3,(H,15,16,18)