1-(3-phenylpropylsulfonyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperidine-4-carboxamide

Systemtic Name: 1-(3-phenylpropylsulfonyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperidine-4-carboxamide Openeye Name: 1-(3-phenylpropylsulfonyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperidine-4-carboxamide CAS Name: 1-(3-phenylpropylsulfonyl)-N-[4-(2-pyrimidinylsulfamoyl)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-phenylpropylsulfonyl)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]piperidine-4-carboxamide Traditional Name: 1-(3-phenylpropylsulfonyl)-N-[4-(2-pyrimidylsulfamoyl)phenyl]isonipecotamide Formula: C25H29N5O5S2 MolecularWeight: 543.65826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)S(=O)(=O)CCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CC=N3)S(=O)(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C25H29N5O5S2/c31-24(28-22-9-11-23(12-10-22)37(34,35)29-25-26-15-5-16-27-25)21-13-17-30(18-14-21)36(32,33)19-4-8-20-6-2-1-3-7-20/h1-3,5-7,9-12,15-16,21H,4,8,13-14,17-19H2,(H,28,31)(H,26,27,29)