4-[(6-bromanyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanylmethyl]benzoate

Systemtic Name: 4-[(6-bromanyl-1H-imidazo[4,5-b]pyridin-2-yl)sulfanylmethyl]benzoate Openeye Name: 4-[(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)sulfanylmethyl]benzoate CAS Name: 4-[[(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)thio]methyl]benzoate IUPAC Name: 4-[(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(6-bromo-1H-imidazo[4,5-b]pyridin-2-yl)thio]methyl]benzoate Formula: C14H9BrN3O2S- MolecularWeight: 363.20916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NC3=NC=C(C=C3N2)Br)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CSC2=NC3=NC=C(C=C3N2)Br)C(=O)[O-]

InChI

InChI=1S/C14H10BrN3O2S/c15-10-5-11-12(16-6-10)18-14(17-11)21-7-8-1-3-9(4-2-8)13(19)20/h1-6H,7H2,(H,19,20)(H,16,17,18)/p-1