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

Systemtic Name: (2R)-2-[(6-bromanyl-1H-benzimidazol-2-yl)sulfanyl]butanoate Openeye Name: (2R)-2-[(6-bromo-1H-benzimidazol-2-yl)sulfanyl]butanoate CAS Name: (2R)-2-[(6-bromo-1H-benzimidazol-2-yl)thio]butanoate IUPAC Name: (2R)-2-[(6-bromo-1H-benzimidazol-2-yl)sulfanyl]butanoate Traditional Name: (2R)-2-[(6-bromo-1H-benzimidazol-2-yl)thio]butyrate Formula: C11H10BrN2O2S- MolecularWeight: 314.1783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11BrN2O2S/c1-2-9(10(15)16)17-11-13-7-4-3-6(12)5-8(7)14-11/h3-5,9H,2H2,1H3,(H,13,14)(H,15,16)/p-1/t9-/m1/s1