(2R)-2-(6-ethylquinazolin-4-yl)sulfanylpropanoate

Systemtic Name: (2R)-2-(6-ethylquinazolin-4-yl)sulfanylpropanoate Openeye Name: (2R)-2-(6-ethylquinazolin-4-yl)sulfanylpropanoate CAS Name: (2R)-2-[(6-ethyl-4-quinazolinyl)thio]propanoate IUPAC Name: (2R)-2-(6-ethylquinazolin-4-yl)sulfanylpropanoate Traditional Name: (2R)-2-[(6-ethylquinazolin-4-yl)thio]propionate Formula: C13H13N2O2S- MolecularWeight: 261.31952

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=CN=C2SC(C)C(=O)[O-]

Isomeric SMILES

CCC1=CC2=C(C=C1)N=CN=C2S[C@H](C)C(=O)[O-]

InChI

InChI=1S/C13H14N2O2S/c1-3-9-4-5-11-10(6-9)12(15-7-14-11)18-8(2)13(16)17/h4-8H,3H2,1-2H3,(H,16,17)/p-1/t8-/m1/s1