4-chloranyl-3-cyclobutyl-5-[(4-ethanoylphenyl)methyl]-2-methyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-3-cyclobutyl-5-[(4-ethanoylphenyl)methyl]-2-methyl-benzenesulfonamide Openeye Name: 5-[(4-acetylphenyl)methyl]-4-chloro-3-cyclobutyl-2-methyl-benzenesulfonamide CAS Name: 5-[(4-acetylphenyl)methyl]-4-chloro-3-cyclobutyl-2-methylbenzenesulfonamide IUPAC Name: 5-[(4-acetylphenyl)methyl]-4-chloro-3-cyclobutyl-2-methylbenzenesulfonamide Traditional Name: 5-(4-acetylbenzyl)-4-chloro-3-cyclobutyl-2-methyl-benzenesulfonamide Formula: C20H22ClNO3S MolecularWeight: 391.91158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1C2CCC2)Cl)CC3=CC=C(C=C3)C(=O)C)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C(=C1C2CCC2)Cl)CC3=CC=C(C=C3)C(=O)C)S(=O)(=O)N

InChI

InChI=1S/C20H22ClNO3S/c1-12-18(26(22,24)25)11-17(20(21)19(12)16-4-3-5-16)10-14-6-8-15(9-7-14)13(2)23/h6-9,11,16H,3-5,10H2,1-2H3,(H2,22,24,25)