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The PubChem CID is 817611.
The molecular formula is C15H12N2O2S.
The IUPAC name is 2-(1-phenylbenzimidazol-2-yl)sulfanylacetic acid.
The InChI is InChI=1S/C15H12N2O2S/c18-14(19)10-20-15-16-12-8-4-5-9-13(12)17(15)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,19).
The InChIKey is QJUFLXCQZGILJZ-UHFFFAOYSA-N.
The canonical SMILES is C1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)O.
The molecular weight is 284.3 g/mol.
The XLogP3-AA value is 3.5.
There is 1 hydrogen bond donor count.
There are 4 hydrogen bond acceptor counts.
93859-58-6
93863-88-8
93863-89-9
93866-50-3
93870-41-8
93873-16-6
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