2-[(4-thiophen-2-yl-1,3-thiazol-2-yl)methylsulfanyl]benzoic acid

Systemtic Name: 2-[(4-thiophen-2-yl-1,3-thiazol-2-yl)methylsulfanyl]benzoic acid Openeye Name: 2-[[4-(2-thienyl)thiazol-2-yl]methylsulfanyl]benzoic acid CAS Name: 2-[(4-thiophen-2-yl-2-thiazolyl)methylthio]benzoic acid IUPAC Name: 2-[(4-thiophen-2-yl-1,3-thiazol-2-yl)methylsulfanyl]benzoic acid Traditional Name: 2-[[4-(2-thienyl)thiazol-2-yl]methylthio]benzoic acid Formula: C15H11NO2S3 MolecularWeight: 333.44834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)SCC2=NC(=CS2)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)SCC2=NC(=CS2)C3=CC=CS3

InChI

InChI=1S/C15H11NO2S3/c17-15(18)10-4-1-2-5-12(10)20-9-14-16-11(8-21-14)13-6-3-7-19-13/h1-8H,9H2,(H,17,18)