3-(6-bromanylquinazolin-4-yl)sulfanylpropanoate

Systemtic Name: 3-(6-bromanylquinazolin-4-yl)sulfanylpropanoate Openeye Name: 3-(6-bromoquinazolin-4-yl)sulfanylpropanoate CAS Name: 3-[(6-bromo-4-quinazolinyl)thio]propanoate IUPAC Name: 3-(6-bromoquinazolin-4-yl)sulfanylpropanoate Traditional Name: 3-[(6-bromoquinazolin-4-yl)thio]propionate Formula: C11H8BrN2O2S- MolecularWeight: 312.16242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(=NC=N2)SCCC(=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Br)C(=NC=N2)SCCC(=O)[O-]

InChI

InChI=1S/C11H9BrN2O2S/c12-7-1-2-9-8(5-7)11(14-6-13-9)17-4-3-10(15)16/h1-2,5-6H,3-4H2,(H,15,16)/p-1