(2R)-2-(1-phenethylbenzimidazol-2-yl)sulfanylpropanoate

Systemtic Name: (2R)-2-(1-phenethylbenzimidazol-2-yl)sulfanylpropanoate Openeye Name: (2R)-2-(1-phenethylbenzimidazol-2-yl)sulfanylpropanoate CAS Name: (2R)-2-[(1-phenethyl-2-benzimidazolyl)thio]propanoate IUPAC Name: (2R)-2-(1-phenethylbenzimidazol-2-yl)sulfanylpropanoate Traditional Name: (2R)-2-[(1-phenethylbenzimidazol-2-yl)thio]propionate Formula: C18H17N2O2S- MolecularWeight: 325.40478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SC1=NC2=CC=CC=C2N1CCC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)[O-])SC1=NC2=CC=CC=C2N1CCC3=CC=CC=C3

InChI

InChI=1S/C18H18N2O2S/c1-13(17(21)22)23-18-19-15-9-5-6-10-16(15)20(18)12-11-14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3,(H,21,22)/p-1/t13-/m1/s1