1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[2-(pyrazol-1-ylmethyl)benzyl]isonipecotamide Formula: C25H28N4O5S MolecularWeight: 496.57862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CC=C2CN3C=CC=N3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CC=C2CN3C=CC=N3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C25H28N4O5S/c30-25(26-17-20-4-1-2-5-21(20)18-28-11-3-10-27-28)19-8-12-29(13-9-19)35(31,32)22-6-7-23-24(16-22)34-15-14-33-23/h1-7,10-11,16,19H,8-9,12-15,17-18H2,(H,26,30)