6-(6-bromanyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanoate

Systemtic Name: 6-(6-bromanyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanoate Openeye Name: 6-(6-bromo-4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanoate CAS Name: 6-(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanoate IUPAC Name: 6-(6-bromo-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanoate Traditional Name: 6-(6-bromo-4-keto-2-thioxo-1H-quinazolin-3-yl)hexanoate Formula: C14H14BrN2O3S- MolecularWeight: 370.24156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=O)N(C(=S)N2)CCCCCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=O)N(C(=S)N2)CCCCCC(=O)[O-]

InChI

InChI=1S/C14H15BrN2O3S/c15-9-5-6-11-10(8-9)13(20)17(14(21)16-11)7-3-1-2-4-12(18)19/h5-6,8H,1-4,7H2,(H,16,21)(H,18,19)/p-1