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

Systemtic Name: 2-[[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]methylsulfanyl]benzoic acid Openeye Name: 2-[[4-(benzofuran-2-yl)thiazol-2-yl]methylsulfanyl]benzoic acid CAS Name: 2-[[4-(2-benzofuranyl)-2-thiazolyl]methylthio]benzoic acid IUPAC Name: 2-[[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]methylsulfanyl]benzoic acid Traditional Name: 2-[[4-(benzofuran-2-yl)thiazol-2-yl]methylthio]benzoic acid Formula: C19H13NO3S2 MolecularWeight: 367.44142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C3=CSC(=N3)CSC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C3=CSC(=N3)CSC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C19H13NO3S2/c21-19(22)13-6-2-4-8-17(13)24-11-18-20-14(10-25-18)16-9-12-5-1-3-7-15(12)23-16/h1-10H,11H2,(H,21,22)