phenyl 5-methylsulfanyl-3-(phenylsulfonyl)imidazo[1,2-a]pyridine-7-sulfonate

Systemtic Name: phenyl 5-methylsulfanyl-3-(phenylsulfonyl)imidazo[1,2-a]pyridine-7-sulfonate Openeye Name: phenyl 3-(benzenesulfonyl)-5-methylsulfanyl-imidazo[1,2-a]pyridine-7-sulfonate CAS Name: 3-(benzenesulfonyl)-5-(methylthio)-7-imidazo[1,2-a]pyridinesulfonic acid phenyl ester IUPAC Name: phenyl 3-(benzenesulfonyl)-5-methylsulfanylimidazo[1,2-a]pyridine-7-sulfonate Traditional Name: 3-besyl-5-(methylthio)imidazo[1,2-a]pyridine-7-sulfonic acid phenyl ester Formula: C20H16N2O5S3 MolecularWeight: 460.54644

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=CC2=NC=C(N12)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CSC1=CC(=CC2=NC=C(N12)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C20H16N2O5S3/c1-28-19-13-17(30(25,26)27-15-8-4-2-5-9-15)12-18-21-14-20(22(18)19)29(23,24)16-10-6-3-7-11-16/h2-14H,1H3