(2S)-2-(2-methylsulfanylbenzimidazol-1-yl)-2-phenyl-ethanoate

Systemtic Name: (2S)-2-(2-methylsulfanylbenzimidazol-1-yl)-2-phenyl-ethanoate Openeye Name: (2S)-2-(2-methylsulfanylbenzimidazol-1-yl)-2-phenyl-acetate CAS Name: (2S)-2-[2-(methylthio)-1-benzimidazolyl]-2-phenylacetate IUPAC Name: (2S)-2-(2-methylsulfanylbenzimidazol-1-yl)-2-phenylacetate Traditional Name: (2S)-2-[2-(methylthio)benzimidazol-1-yl]-2-phenyl-acetate Formula: C16H13N2O2S- MolecularWeight: 297.35162

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=CC=CC=C2N1C(C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CSC1=NC2=CC=CC=C2N1[C@@H](C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C16H14N2O2S/c1-21-16-17-12-9-5-6-10-13(12)18(16)14(15(19)20)11-7-3-2-4-8-11/h2-10,14H,1H3,(H,19,20)/p-1/t14-/m0/s1