4-[2-[(6-chloranyl-1H-imidazo[4,5-b]pyridin-4-ium-2-yl)sulfanyl]ethanoyl]-2-oxidanyl-phenolate

Systemtic Name: 4-[2-[(6-chloranyl-1H-imidazo[4,5-b]pyridin-4-ium-2-yl)sulfanyl]ethanoyl]-2-oxidanyl-phenolate Openeye Name: 4-[2-[(6-chloro-1H-imidazo[4,5-b]pyridin-4-ium-2-yl)sulfanyl]acetyl]-2-hydroxy-phenolate CAS Name: 4-[2-[(6-chloro-1H-imidazo[4,5-b]pyridin-4-ium-2-yl)thio]-1-oxoethyl]-2-hydroxyphenolate IUPAC Name: 4-[2-[(6-chloro-1H-imidazo[4,5-b]pyridin-4-ium-2-yl)sulfanyl]acetyl]-2-hydroxyphenolate Traditional Name: 4-[2-[(6-chloro-1H-imidazo[4,5-b]pyridin-4-ium-2-yl)thio]acetyl]-2-hydroxy-phenolate Formula: C14H10ClN3O3S MolecularWeight: 335.7655

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)CSC2=NC3=[NH+]C=C(C=C3N2)Cl)O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C(=O)CSC2=NC3=[NH+]C=C(C=C3N2)Cl)O)[O-]

InChI

InChI=1S/C14H10ClN3O3S/c15-8-4-9-13(16-5-8)18-14(17-9)22-6-12(21)7-1-2-10(19)11(20)3-7/h1-5,19-20H,6H2,(H,16,17,18)