3-phenyl-2-[4-(1,3-thiazol-2-ylsulfanyl)phenyl]propanoic acid

Systemtic Name: 3-phenyl-2-[4-(1,3-thiazol-2-ylsulfanyl)phenyl]propanoic acid Openeye Name: 3-phenyl-2-(4-thiazol-2-ylsulfanylphenyl)propanoic acid CAS Name: 3-phenyl-2-[4-(2-thiazolylthio)phenyl]propanoic acid IUPAC Name: 3-phenyl-2-[4-(1,3-thiazol-2-ylsulfanyl)phenyl]propanoic acid Traditional Name: 3-phenyl-2-[4-(thiazol-2-ylthio)phenyl]propionic acid Formula: C18H15NO2S2 MolecularWeight: 341.4472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=CC=C(C=C2)SC3=NC=CS3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(C2=CC=C(C=C2)SC3=NC=CS3)C(=O)O

InChI

InChI=1S/C18H15NO2S2/c20-17(21)16(12-13-4-2-1-3-5-13)14-6-8-15(9-7-14)23-18-19-10-11-22-18/h1-11,16H,12H2,(H,20,21)