N-[3-(diethylamino)-2-methyl-propyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[3-(diethylamino)-2-methyl-propyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[3-(diethylamino)-2-methyl-propyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[3-(diethylamino)-2-methylpropyl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[3-(diethylamino)-2-methylpropyl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(diethylamino)-2-methyl-propyl]-1-tosyl-isonipecotamide Formula: C21H35N3O3S MolecularWeight: 409.5859

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(C)CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC)CC(C)CNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H35N3O3S/c1-5-23(6-2)16-18(4)15-22-21(25)19-11-13-24(14-12-19)28(26,27)20-9-7-17(3)8-10-20/h7-10,18-19H,5-6,11-16H2,1-4H3,(H,22,25)