3-[(3-methylphenyl)-methylsulfonyl-amino]propane-1-sulfonamide

Systemtic Name: 3-[(3-methylphenyl)-methylsulfonyl-amino]propane-1-sulfonamide Openeye Name: 3-(3-methyl-N-methylsulfonyl-anilino)propane-1-sulfonamide CAS Name: 3-(3-methyl-N-methylsulfonylanilino)-1-propanesulfonamide IUPAC Name: 3-(3-methyl-N-methylsulfonylanilino)propane-1-sulfonamide Traditional Name: 3-(N-mesyl-3-methyl-anilino)propane-1-sulfonamide Formula: C11H18N2O4S2 MolecularWeight: 306.40162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CCCS(=O)(=O)N)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CCCS(=O)(=O)N)S(=O)(=O)C

InChI

InChI=1S/C11H18N2O4S2/c1-10-5-3-6-11(9-10)13(18(2,14)15)7-4-8-19(12,16)17/h3,5-6,9H,4,7-8H2,1-2H3,(H2,12,16,17)