3-(6-ethylquinazolin-4-yl)sulfanylpropanoic acid

Systemtic Name: 3-(6-ethylquinazolin-4-yl)sulfanylpropanoic acid Openeye Name: 3-(6-ethylquinazolin-4-yl)sulfanylpropanoic acid CAS Name: 3-[(6-ethyl-4-quinazolinyl)thio]propanoic acid IUPAC Name: 3-(6-ethylquinazolin-4-yl)sulfanylpropanoic acid Traditional Name: 3-[(6-ethylquinazolin-4-yl)thio]propionic acid Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=CN=C2SCCC(=O)O

Isomeric SMILES

CCC1=CC2=C(C=C1)N=CN=C2SCCC(=O)O

InChI

InChI=1S/C13H14N2O2S/c1-2-9-3-4-11-10(7-9)13(15-8-14-11)18-6-5-12(16)17/h3-4,7-8H,2,5-6H2,1H3,(H,16,17)