(2R)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]butanoate

Systemtic Name: (2R)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]butanoate Openeye Name: (2R)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]butanoate CAS Name: (2R)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]butanoate IUPAC Name: (2R)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]butanoate Traditional Name: (2R)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]butyrate Formula: C12H13N2O2S- MolecularWeight: 249.30882

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)[O-])SC1=NC2=C(N1)C=C(C=C2)C

Isomeric SMILES

CC[C@H](C(=O)[O-])SC1=NC2=C(N1)C=C(C=C2)C

InChI

InChI=1S/C12H14N2O2S/c1-3-10(11(15)16)17-12-13-8-5-4-7(2)6-9(8)14-12/h4-6,10H,3H2,1-2H3,(H,13,14)(H,15,16)/p-1/t10-/m1/s1