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

Systemtic Name: 2-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]methylsulfanyl]benzoic acid Openeye Name: 2-[[4-(4-phenylphenyl)thiazol-2-yl]methylsulfanyl]benzoic acid CAS Name: 2-[[4-(4-phenylphenyl)-2-thiazolyl]methylthio]benzoic acid IUPAC Name: 2-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]methylsulfanyl]benzoic acid Traditional Name: 2-[[4-(4-phenylphenyl)thiazol-2-yl]methylthio]benzoic acid Formula: C23H17NO2S2 MolecularWeight: 403.51658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CSC(=N3)CSC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CSC(=N3)CSC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C23H17NO2S2/c25-23(26)19-8-4-5-9-21(19)27-15-22-24-20(14-28-22)18-12-10-17(11-13-18)16-6-2-1-3-7-16/h1-14H,15H2,(H,25,26)