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

Systemtic Name: ethyl 2-[[6,8-bis(bromanyl)-4-oxidanylidene-1H-quinazolin-2-yl]methylsulfanyl]ethanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C13H12Br2N2O3S MolecularWeight: 436.11898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12Br2N2O3S/c1-2-20-11(18)6-21-5-10-16-12-8(13(19)17-10)3-7(14)4-9(12)15/h3-4H,2,5-6H2,1H3,(H,16,17,19)