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

Systemtic Name: (2S)-2-(2-ethylsulfanylbenzimidazol-1-yl)-2-phenyl-ethanoate Openeye Name: (2S)-2-(2-ethylsulfanylbenzimidazol-1-yl)-2-phenyl-acetate CAS Name: (2S)-2-[2-(ethylthio)-1-benzimidazolyl]-2-phenylacetate IUPAC Name: (2S)-2-(2-ethylsulfanylbenzimidazol-1-yl)-2-phenylacetate Traditional Name: (2S)-2-[2-(ethylthio)benzimidazol-1-yl]-2-phenyl-acetate Formula: C17H15N2O2S- MolecularWeight: 311.3782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=CC=CC=C2N1C(C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CCSC1=NC2=CC=CC=C2N1[C@@H](C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C17H16N2O2S/c1-2-22-17-18-13-10-6-7-11-14(13)19(17)15(16(20)21)12-8-4-3-5-9-12/h3-11,15H,2H2,1H3,(H,20,21)/p-1/t15-/m0/s1