2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]hexanoic acid

Systemtic Name: 2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]hexanoic acid Openeye Name: 2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]hexanoic acid CAS Name: 2-[(5-phenyl-1H-imidazol-2-yl)thio]hexanoic acid IUPAC Name: 2-[(5-phenyl-1H-imidazol-2-yl)sulfanyl]hexanoic acid Traditional Name: 2-[(5-phenyl-1H-imidazol-2-yl)thio]hexanoic acid Formula: C15H18N2O2S MolecularWeight: 290.38062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)SC1=NC=C(N1)C2=CC=CC=C2

Isomeric SMILES

CCCCC(C(=O)O)SC1=NC=C(N1)C2=CC=CC=C2

InChI

InChI=1S/C15H18N2O2S/c1-2-3-9-13(14(18)19)20-15-16-10-12(17-15)11-7-5-4-6-8-11/h4-8,10,13H,2-3,9H2,1H3,(H,16,17)(H,18,19)