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

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

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC=C(N2C(=C1)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

CSC1=CC2=NC=C(N2C(=C1)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)OC4=CC=CC=C4

InChI

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