4-butyl-N-[(4-methylsulfonylphenyl)methyl]benzenesulfonamide

Systemtic Name: 4-butyl-N-[(4-methylsulfonylphenyl)methyl]benzenesulfonamide Openeye Name: 4-butyl-N-[(4-methylsulfonylphenyl)methyl]benzenesulfonamide CAS Name: 4-butyl-N-[(4-methylsulfonylphenyl)methyl]benzenesulfonamide IUPAC Name: 4-butyl-N-[(4-methylsulfonylphenyl)methyl]benzenesulfonamide Traditional Name: 4-butyl-N-(4-mesylbenzyl)benzenesulfonamide Formula: C18H23NO4S2 MolecularWeight: 381.50952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C18H23NO4S2/c1-3-4-5-15-6-12-18(13-7-15)25(22,23)19-14-16-8-10-17(11-9-16)24(2,20)21/h6-13,19H,3-5,14H2,1-2H3