2-(1-phenylimidazol-2-yl)sulfanylpropanoic acid

Systemtic Name: 2-(1-phenylimidazol-2-yl)sulfanylpropanoic acid Openeye Name: 2-(1-phenylimidazol-2-yl)sulfanylpropanoic acid CAS Name: 2-[(1-phenyl-2-imidazolyl)thio]propanoic acid IUPAC Name: 2-(1-phenylimidazol-2-yl)sulfanylpropanoic acid Traditional Name: 2-[(1-phenylimidazol-2-yl)thio]propionic acid Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NC=CN1C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)O)SC1=NC=CN1C2=CC=CC=C2

InChI

InChI=1S/C12H12N2O2S/c1-9(11(15)16)17-12-13-7-8-14(12)10-5-3-2-4-6-10/h2-9H,1H3,(H,15,16)