N-[3,3-dimethyl-2-[[(4-methylphenyl)sulfonylamino]methyl]butyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[3,3-dimethyl-2-[[(4-methylphenyl)sulfonylamino]methyl]butyl]-4-methyl-benzenesulfonamide Openeye Name: N-[3,3-dimethyl-2-[(p-tolylsulfonylamino)methyl]butyl]-4-methyl-benzenesulfonamide CAS Name: N-[3,3-dimethyl-2-[[(4-methylphenyl)sulfonylamino]methyl]butyl]-4-methylbenzenesulfonamide IUPAC Name: N-[3,3-dimethyl-2-[[(4-methylphenyl)sulfonylamino]methyl]butyl]-4-methylbenzenesulfonamide Traditional Name: N-[3,3-dimethyl-2-[(tosylamino)methyl]butyl]-4-methyl-benzenesulfonamide Formula: C21H30N2O4S2 MolecularWeight: 438.6039

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC(CNS(=O)(=O)C2=CC=C(C=C2)C)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC(CNS(=O)(=O)C2=CC=C(C=C2)C)C(C)(C)C

InChI

InChI=1S/C21H30N2O4S2/c1-16-6-10-19(11-7-16)28(24,25)22-14-18(21(3,4)5)15-23-29(26,27)20-12-8-17(2)9-13-20/h6-13,18,22-23H,14-15H2,1-5H3