3-(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonyl-6,8-bis(chloranyl)-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-(5-bromanyl-2-methoxy-3-methyl-phenyl)carbonyl-6,8-bis(chloranyl)-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-(5-bromo-2-methoxy-3-methyl-benzoyl)-6,8-dichloro-2-thioxo-quinazolin-4-olate CAS Name: 3-[(5-bromo-2-methoxy-3-methylphenyl)-oxomethyl]-6,8-dichloro-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-(5-bromo-2-methoxy-3-methylbenzoyl)-6,8-dichloro-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-(5-bromo-2-methoxy-3-methyl-benzoyl)-6,8-dichloro-2-thioxo-quinazolin-4-olate Formula: C17H10BrCl2N2O3S- MolecularWeight: 473.1479

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)N2C(=C3C=C(C=C(C3=NC2=S)Cl)Cl)[O-])OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)N2C(=C3C=C(C=C(C3=NC2=S)Cl)Cl)[O-])OC

InChI

InChI=1S/C17H11BrCl2N2O3S/c1-7-3-8(18)4-11(14(7)25-2)16(24)22-15(23)10-5-9(19)6-12(20)13(10)21-17(22)26/h3-6,23H,1-2H3/p-1