(2R)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]butanoic acid

Systemtic Name: (2R)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]butanoic acid Openeye Name: (2R)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]butanoic acid CAS Name: (2R)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]butanoic acid IUPAC Name: (2R)-2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]butanoic acid Traditional Name: (2R)-2-[(6-methoxy-1H-benzimidazol-2-yl)thio]butyric acid Formula: C12H14N2O3S MolecularWeight: 266.31616

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)SC1=NC2=C(N1)C=C(C=C2)OC

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O3S/c1-3-10(11(15)16)18-12-13-8-5-4-7(17-2)6-9(8)14-12/h4-6,10H,3H2,1-2H3,(H,13,14)(H,15,16)/t10-/m1/s1