3-(3-bromanyl-4-methoxy-phenyl)carbonyl-6,8-bis(chloranyl)-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-(3-bromanyl-4-methoxy-phenyl)carbonyl-6,8-bis(chloranyl)-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-(3-bromo-4-methoxy-benzoyl)-6,8-dichloro-2-thioxo-quinazolin-4-olate CAS Name: 3-[(3-bromo-4-methoxyphenyl)-oxomethyl]-6,8-dichloro-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-(3-bromo-4-methoxybenzoyl)-6,8-dichloro-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-(3-bromo-4-methoxy-benzoyl)-6,8-dichloro-2-thioxo-quinazolin-4-olate Formula: C16H8BrCl2N2O3S- MolecularWeight: 459.12132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2C(=C3C=C(C=C(C3=NC2=S)Cl)Cl)[O-])Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2C(=C3C=C(C=C(C3=NC2=S)Cl)Cl)[O-])Br

InChI

InChI=1S/C16H9BrCl2N2O3S/c1-24-12-3-2-7(4-10(12)17)14(22)21-15(23)9-5-8(18)6-11(19)13(9)20-16(21)25/h2-6,23H,1H3/p-1