2,5-dimethyl-N-(phenylmethyl)-3-(phenylsulfonyl)benzenesulfonamide

Systemtic Name: 2,5-dimethyl-N-(phenylmethyl)-3-(phenylsulfonyl)benzenesulfonamide Openeye Name: 3-(benzenesulfonyl)-N-benzyl-2,5-dimethyl-benzenesulfonamide CAS Name: 3-(benzenesulfonyl)-2,5-dimethyl-N-(phenylmethyl)benzenesulfonamide IUPAC Name: 3-(benzenesulfonyl)-N-benzyl-2,5-dimethylbenzenesulfonamide Traditional Name: N-benzyl-3-besyl-2,5-dimethyl-benzenesulfonamide Formula: C21H21NO4S2 MolecularWeight: 415.52574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)S(=O)(=O)NCC2=CC=CC=C2)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C(=C1)S(=O)(=O)NCC2=CC=CC=C2)C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H21NO4S2/c1-16-13-20(27(23,24)19-11-7-4-8-12-19)17(2)21(14-16)28(25,26)22-15-18-9-5-3-6-10-18/h3-14,22H,15H2,1-2H3