N-(1-azanyl-3-phenyl-propan-2-yl)-4-methyl-N-(4-methylphenyl)sulfonyl-benzenesulfonamide

Systemtic Name: N-(1-azanyl-3-phenyl-propan-2-yl)-4-methyl-N-(4-methylphenyl)sulfonyl-benzenesulfonamide Openeye Name: N-[1-(aminomethyl)-2-phenyl-ethyl]-4-methyl-N-(p-tolylsulfonyl)benzenesulfonamide CAS Name: N-(1-amino-3-phenylpropan-2-yl)-4-methyl-N-(4-methylphenyl)sulfonylbenzenesulfonamide IUPAC Name: N-(1-amino-3-phenylpropan-2-yl)-4-methyl-N-(4-methylphenyl)sulfonylbenzenesulfonamide Traditional Name: N-[1-(aminomethyl)-2-phenyl-ethyl]-4-methyl-N-tosyl-benzenesulfonamide Formula: C23H26N2O4S2 MolecularWeight: 458.59354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O4S2/c1-18-8-12-22(13-9-18)30(26,27)25(21(17-24)16-20-6-4-3-5-7-20)31(28,29)23-14-10-19(2)11-15-23/h3-15,21H,16-17,24H2,1-2H3