(2R,3R)-5-bromanyl-2-(imidazol-1-ylmethyl)-2,3-dihydro-1-benzothiophen-3-ol

Systemtic Name: (2R,3R)-5-bromanyl-2-(imidazol-1-ylmethyl)-2,3-dihydro-1-benzothiophen-3-ol Openeye Name: (2R,3R)-5-bromo-2-(imidazol-1-ylmethyl)-2,3-dihydrobenzothiophen-3-ol CAS Name: (2R,3R)-5-bromo-2-(1-imidazolylmethyl)-2,3-dihydro-1-benzothiophen-3-ol IUPAC Name: (2R,3R)-5-bromo-2-(imidazol-1-ylmethyl)-2,3-dihydro-1-benzothiophen-3-ol Traditional Name: (2R,3R)-5-bromo-2-(imidazol-1-ylmethyl)-2,3-dihydrobenzothiophen-3-ol Formula: C12H11BrN2OS MolecularWeight: 311.19754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Br)C(C(S2)CN3C=CN=C3)O

Isomeric SMILES

C1=CC2=C(C=C1Br)[C@H]([C@H](S2)CN3C=CN=C3)O

InChI

InChI=1S/C12H11BrN2OS/c13-8-1-2-10-9(5-8)12(16)11(17-10)6-15-4-3-14-7-15/h1-5,7,11-12,16H,6H2/t11-,12-/m1/s1