N-methyl-1-methylsulfonyl-N-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl]piperidine-4-carboxamide

Systemtic Name: N-methyl-1-methylsulfonyl-N-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl]piperidine-4-carboxamide Openeye Name: N-methyl-1-methylsulfonyl-N-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]piperidine-4-carboxamide CAS Name: N-methyl-1-methylsulfonyl-N-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methyl]-4-piperidinecarboxamide IUPAC Name: N-methyl-1-methylsulfonyl-N-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-mesyl-N-methyl-N-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]isonipecotamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3)C(=O)C4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC=CS2)C3=CC=CC=C3)C(=O)C4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C22H26N4O3S2/c1-24(22(27)17-10-12-25(13-11-17)31(2,28)29)15-18-16-26(19-7-4-3-5-8-19)23-21(18)20-9-6-14-30-20/h3-9,14,16-17H,10-13,15H2,1-2H3