N-[[2-(dimethylamino)pyridin-3-yl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[[2-(dimethylamino)-3-pyridinyl]methyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[2-(dimethylamino)pyridin-3-yl]methyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[[2-(dimethylamino)-3-pyridyl]methyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C18H24N4O3S2 MolecularWeight: 408.53816

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC=N1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(C)C1=C(C=CC=N1)CNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H24N4O3S2/c1-21(2)17-15(5-3-9-19-17)13-20-18(23)14-7-10-22(11-8-14)27(24,25)16-6-4-12-26-16/h3-6,9,12,14H,7-8,10-11,13H2,1-2H3,(H,20,23)