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

Systemtic Name: 6,8-bis(chloranyl)-3-(3-chloranyl-4-methoxy-phenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 6,8-dichloro-3-(3-chloro-4-methoxy-benzoyl)-2-thioxo-quinazolin-4-olate CAS Name: 6,8-dichloro-3-[(3-chloro-4-methoxyphenyl)-oxomethyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 6,8-dichloro-3-(3-chloro-4-methoxybenzoyl)-2-sulfanylidenequinazolin-4-olate Traditional Name: 6,8-dichloro-3-(3-chloro-4-methoxy-benzoyl)-2-thioxo-quinazolin-4-olate Formula: C16H8Cl3N2O3S- MolecularWeight: 414.67032

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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-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C16H9Cl3N2O3S/c1-24-12-3-2-7(4-10(12)18)14(22)21-15(23)9-5-8(17)6-11(19)13(9)20-16(21)25/h2-6,23H,1H3/p-1