phenyl 5-bromanyl-7-methylsulfanyl-imidazo[1,2-a]pyridine-3-sulfonate

Systemtic Name: phenyl 5-bromanyl-7-methylsulfanyl-imidazo[1,2-a]pyridine-3-sulfonate Openeye Name: phenyl 5-bromo-7-methylsulfanyl-imidazo[1,2-a]pyridine-3-sulfonate CAS Name: 5-bromo-7-(methylthio)-3-imidazo[1,2-a]pyridinesulfonic acid phenyl ester IUPAC Name: phenyl 5-bromo-7-methylsulfanylimidazo[1,2-a]pyridine-3-sulfonate Traditional Name: 5-bromo-7-(methylthio)imidazo[1,2-a]pyridine-3-sulfonic acid phenyl ester Formula: C14H11BrN2O3S2 MolecularWeight: 399.28274

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC=C(N2C(=C1)Br)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CSC1=CC2=NC=C(N2C(=C1)Br)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C14H11BrN2O3S2/c1-21-11-7-12(15)17-13(8-11)16-9-14(17)22(18,19)20-10-5-3-2-4-6-10/h2-9H,1H3