N-[[2-(dimethylamino)pyridin-3-yl]methyl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-1-(4-propan-2-ylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-1-(4-isopropylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[[2-(dimethylamino)-3-pyridinyl]methyl]-1-(4-propan-2-ylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-1-p-cumenylsulfonyl-isonipecotamide Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=C(N=CC=C3)N(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=C(N=CC=C3)N(C)C

InChI

InChI=1S/C23H32N4O3S/c1-17(2)18-7-9-21(10-8-18)31(29,30)27-14-11-19(12-15-27)23(28)25-16-20-6-5-13-24-22(20)26(3)4/h5-10,13,17,19H,11-12,14-16H2,1-4H3,(H,25,28)