3-[3,5-bis(bromanyl)-2-methoxy-phenyl]carbonyl-6-bromanyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[3,5-bis(bromanyl)-2-methoxy-phenyl]carbonyl-6-bromanyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6-bromo-3-(3,5-dibromo-2-methoxy-benzoyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 6-bromo-3-[(3,5-dibromo-2-methoxyphenyl)-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6-bromo-3-(3,5-dibromo-2-methoxybenzoyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6-bromo-3-(3,5-dibromo-2-methoxy-benzoyl)-2-thioxo-1H-quinazolin-4-one Formula: C16H9Br3N2O3S MolecularWeight: 549.03126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C(=O)N2C(=O)C3=C(C=CC(=C3)Br)NC2=S)Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1C(=O)N2C(=O)C3=C(C=CC(=C3)Br)NC2=S)Br)Br

InChI

InChI=1S/C16H9Br3N2O3S/c1-24-13-10(5-8(18)6-11(13)19)15(23)21-14(22)9-4-7(17)2-3-12(9)20-16(21)25/h2-6H,1H3,(H,20,25)