methyl 4-[[5-[ethyl(phenyl)sulfamoyl]pyridin-2-yl]sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[[5-[ethyl(phenyl)sulfamoyl]pyridin-2-yl]sulfanylmethyl]benzoate Openeye Name: methyl 4-[[5-[ethyl(phenyl)sulfamoyl]-2-pyridyl]sulfanylmethyl]benzoate CAS Name: 4-[[[5-[ethyl(phenyl)sulfamoyl]-2-pyridinyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-[ethyl(phenyl)sulfamoyl]pyridin-2-yl]sulfanylmethyl]benzoate Traditional Name: 4-[[[5-[ethyl(phenyl)sulfamoyl]-2-pyridyl]thio]methyl]benzoic acid methyl ester Formula: C22H22N2O4S2 MolecularWeight: 442.55108

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CN=C(C=C2)SCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H22N2O4S2/c1-3-24(19-7-5-4-6-8-19)30(26,27)20-13-14-21(23-15-20)29-16-17-9-11-18(12-10-17)22(25)28-2/h4-15H,3,16H2,1-2H3