4-azanyl-N-[[4-(2,3,5-trimethylphenoxy)phenyl]methyl]benzenesulfonamide

Systemtic Name: 4-azanyl-N-[[4-(2,3,5-trimethylphenoxy)phenyl]methyl]benzenesulfonamide Openeye Name: 4-amino-N-[[4-(2,3,5-trimethylphenoxy)phenyl]methyl]benzenesulfonamide CAS Name: 4-amino-N-[[4-(2,3,5-trimethylphenoxy)phenyl]methyl]benzenesulfonamide IUPAC Name: 4-amino-N-[[4-(2,3,5-trimethylphenoxy)phenyl]methyl]benzenesulfonamide Traditional Name: 4-amino-N-[4-(2,3,5-trimethylphenoxy)benzyl]benzenesulfonamide Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)N)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=CC=C(C=C2)CNS(=O)(=O)C3=CC=C(C=C3)N)C)C

InChI

InChI=1S/C22H24N2O3S/c1-15-12-16(2)17(3)22(13-15)27-20-8-4-18(5-9-20)14-24-28(25,26)21-10-6-19(23)7-11-21/h4-13,24H,14,23H2,1-3H3