5-(dimethylaminomethyl)-2-(phenylmethyl)-3-[(phenylmethyl)amino]benzenesulfonamide

Systemtic Name: 5-(dimethylaminomethyl)-2-(phenylmethyl)-3-[(phenylmethyl)amino]benzenesulfonamide Openeye Name: 2-benzyl-3-(benzylamino)-5-(dimethylaminomethyl)benzenesulfonamide CAS Name: 5-(dimethylaminomethyl)-2-(phenylmethyl)-3-[(phenylmethyl)amino]benzenesulfonamide IUPAC Name: 2-benzyl-3-(benzylamino)-5-(dimethylaminomethyl)benzenesulfonamide Traditional Name: 2-benzyl-3-(benzylamino)-5-(dimethylaminomethyl)benzenesulfonamide Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=C(C(=C1)S(=O)(=O)N)CC2=CC=CC=C2)NCC3=CC=CC=C3

Isomeric SMILES

CN(C)CC1=CC(=C(C(=C1)S(=O)(=O)N)CC2=CC=CC=C2)NCC3=CC=CC=C3

InChI

InChI=1S/C23H27N3O2S/c1-26(2)17-20-14-22(25-16-19-11-7-4-8-12-19)21(23(15-20)29(24,27)28)13-18-9-5-3-6-10-18/h3-12,14-15,25H,13,16-17H2,1-2H3,(H2,24,27,28)