N-(4-ethoxyphenyl)-4-[(4-methylsulfanylphenyl)sulfonylamino]benzenesulfonamide

Systemtic Name: N-(4-ethoxyphenyl)-4-[(4-methylsulfanylphenyl)sulfonylamino]benzenesulfonamide Openeye Name: N-(4-ethoxyphenyl)-4-[(4-methylsulfanylphenyl)sulfonylamino]benzenesulfonamide CAS Name: N-(4-ethoxyphenyl)-4-[[4-(methylthio)phenyl]sulfonylamino]benzenesulfonamide IUPAC Name: N-(4-ethoxyphenyl)-4-[(4-methylsulfanylphenyl)sulfonylamino]benzenesulfonamide Traditional Name: 4-[[4-(methylthio)phenyl]sulfonylamino]-N-p-phenetyl-benzenesulfonamide Formula: C21H22N2O5S3 MolecularWeight: 478.60478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C21H22N2O5S3/c1-3-28-18-8-4-16(5-9-18)22-30(24,25)20-12-6-17(7-13-20)23-31(26,27)21-14-10-19(29-2)11-15-21/h4-15,22-23H,3H2,1-2H3