2-quinazolin-4-ylsulfanylpropanoic acid

Systemtic Name: 2-quinazolin-4-ylsulfanylpropanoic acid Openeye Name: 2-quinazolin-4-ylsulfanylpropanoic acid CAS Name: 2-(4-quinazolinylthio)propanoic acid IUPAC Name: 2-quinazolin-4-ylsulfanylpropanoic acid Traditional Name: 2-(quinazolin-4-ylthio)propionic acid Formula: C11H10N2O2S MolecularWeight: 234.2743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NC=NC2=CC=CC=C21

Isomeric SMILES

CC(C(=O)O)SC1=NC=NC2=CC=CC=C21

InChI

InChI=1S/C11H10N2O2S/c1-7(11(14)15)16-10-8-4-2-3-5-9(8)12-6-13-10/h2-7H,1H3,(H,14,15)