N-[2,4-bis(fluoranyl)phenyl]-4-(4-pyrimidin-5-ylphenyl)sulfonyl-piperidine-1-carboxamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-4-(4-pyrimidin-5-ylphenyl)sulfonyl-piperidine-1-carboxamide Openeye Name: N-(2,4-difluorophenyl)-4-(4-pyrimidin-5-ylphenyl)sulfonyl-piperidine-1-carboxamide CAS Name: N-(2,4-difluorophenyl)-4-[4-(5-pyrimidinyl)phenyl]sulfonyl-1-piperidinecarboxamide IUPAC Name: N-(2,4-difluorophenyl)-4-(4-pyrimidin-5-ylphenyl)sulfonylpiperidine-1-carboxamide Traditional Name: N-(2,4-difluorophenyl)-4-[4-(5-pyrimidyl)phenyl]sulfonyl-piperidine-1-carboxamide Formula: C22H20F2N4O3S MolecularWeight: 458.481006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1S(=O)(=O)C2=CC=C(C=C2)C3=CN=CN=C3)C(=O)NC4=C(C=C(C=C4)F)F

Isomeric SMILES

C1CN(CCC1S(=O)(=O)C2=CC=C(C=C2)C3=CN=CN=C3)C(=O)NC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C22H20F2N4O3S/c23-17-3-6-21(20(24)11-17)27-22(29)28-9-7-19(8-10-28)32(30,31)18-4-1-15(2-5-18)16-12-25-14-26-13-16/h1-6,11-14,19H,7-10H2,(H,27,29)