6-bromanyl-3-(3,4-dimethoxyphenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 6-bromanyl-3-(3,4-dimethoxyphenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 6-bromo-3-(3,4-dimethoxybenzoyl)-2-thioxo-quinazolin-4-olate CAS Name: 6-bromo-3-[(3,4-dimethoxyphenyl)-oxomethyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 6-bromo-3-(3,4-dimethoxybenzoyl)-2-sulfanylidenequinazolin-4-olate Traditional Name: 6-bromo-2-thioxo-3-veratroyl-quinazolin-4-olate Formula: C17H12BrN2O4S- MolecularWeight: 420.25718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2C(=C3C=C(C=CC3=NC2=S)Br)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2C(=C3C=C(C=CC3=NC2=S)Br)[O-])OC

InChI

InChI=1S/C17H13BrN2O4S/c1-23-13-6-3-9(7-14(13)24-2)15(21)20-16(22)11-8-10(18)4-5-12(11)19-17(20)25/h3-8,22H,1-2H3/p-1