N-[3,4-bis(fluoranyl)phenyl]sulfonyl-3-[2-(5-phenylhexoxy)-4-(pyrazol-1-ylmethyl)phenyl]propanamide

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]sulfonyl-3-[2-(5-phenylhexoxy)-4-(pyrazol-1-ylmethyl)phenyl]propanamide Openeye Name: N-(3,4-difluorophenyl)sulfonyl-3-[2-(5-phenylhexoxy)-4-(pyrazol-1-ylmethyl)phenyl]propanamide CAS Name: N-(3,4-difluorophenyl)sulfonyl-3-[2-(5-phenylhexoxy)-4-(1-pyrazolylmethyl)phenyl]propanamide IUPAC Name: N-(3,4-difluorophenyl)sulfonyl-3-[2-(5-phenylhexoxy)-4-(pyrazol-1-ylmethyl)phenyl]propanamide Traditional Name: N-(3,4-difluorophenyl)sulfonyl-3-[2-(5-phenylhexoxy)-4-(pyrazol-1-ylmethyl)phenyl]propionamide Formula: C31H33F2N3O4S MolecularWeight: 581.673226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCOC1=C(C=CC(=C1)CN2C=CC=N2)CCC(=O)NS(=O)(=O)C3=CC(=C(C=C3)F)F)C4=CC=CC=C4

Isomeric SMILES

CC(CCCCOC1=C(C=CC(=C1)CN2C=CC=N2)CCC(=O)NS(=O)(=O)C3=CC(=C(C=C3)F)F)C4=CC=CC=C4

InChI

InChI=1S/C31H33F2N3O4S/c1-23(25-9-3-2-4-10-25)8-5-6-19-40-30-20-24(22-36-18-7-17-34-36)11-12-26(30)13-16-31(37)35-41(38,39)27-14-15-28(32)29(33)21-27/h2-4,7,9-12,14-15,17-18,20-21,23H,5-6,8,13,16,19,22H2,1H3,(H,35,37)