N-[2-(dimethylamino)-3-phenyl-propyl]-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzamide

Systemtic Name: N-[2-(dimethylamino)-3-phenyl-propyl]-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzamide Openeye Name: N-[2-(dimethylamino)-3-phenyl-propyl]-4-[methyl(p-tolylsulfonyl)amino]benzamide CAS Name: N-[2-(dimethylamino)-3-phenylpropyl]-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide IUPAC Name: N-[2-(dimethylamino)-3-phenylpropyl]-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide Traditional Name: N-[2-(dimethylamino)-3-phenyl-propyl]-4-[methyl(tosyl)amino]benzamide Formula: C26H31N3O3S MolecularWeight: 465.60764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NCC(CC3=CC=CC=C3)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NCC(CC3=CC=CC=C3)N(C)C

InChI

InChI=1S/C26H31N3O3S/c1-20-10-16-25(17-11-20)33(31,32)29(4)23-14-12-22(13-15-23)26(30)27-19-24(28(2)3)18-21-8-6-5-7-9-21/h5-17,24H,18-19H2,1-4H3,(H,27,30)