3-[(2-methylsulfonylphenyl)sulfonylamino]-4-(propylamino)benzenesulfonamide

Systemtic Name: 3-[(2-methylsulfonylphenyl)sulfonylamino]-4-(propylamino)benzenesulfonamide Openeye Name: 3-[(2-methylsulfonylphenyl)sulfonylamino]-4-(propylamino)benzenesulfonamide CAS Name: 3-[(2-methylsulfonylphenyl)sulfonylamino]-4-(propylamino)benzenesulfonamide IUPAC Name: 3-[(2-methylsulfonylphenyl)sulfonylamino]-4-(propylamino)benzenesulfonamide Traditional Name: 3-[(2-mesylphenyl)sulfonylamino]-4-(propylamino)benzenesulfonamide Formula: C16H21N3O6S3 MolecularWeight: 447.54944

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)S(=O)(=O)N)NS(=O)(=O)C2=CC=CC=C2S(=O)(=O)C

Isomeric SMILES

CCCNC1=C(C=C(C=C1)S(=O)(=O)N)NS(=O)(=O)C2=CC=CC=C2S(=O)(=O)C

InChI

InChI=1S/C16H21N3O6S3/c1-3-10-18-13-9-8-12(27(17,22)23)11-14(13)19-28(24,25)16-7-5-4-6-15(16)26(2,20)21/h4-9,11,18-19H,3,10H2,1-2H3,(H2,17,22,23)