N-[[3-(methylsulfonylamino)phenyl]methyl]-3-(1-phenylpyrazol-4-yl)propanamide

Systemtic Name: N-[[3-(methylsulfonylamino)phenyl]methyl]-3-(1-phenylpyrazol-4-yl)propanamide Openeye Name: N-[[3-(methanesulfonamido)phenyl]methyl]-3-(1-phenylpyrazol-4-yl)propanamide CAS Name: N-[[3-(methanesulfonamido)phenyl]methyl]-3-(1-phenyl-4-pyrazolyl)propanamide IUPAC Name: N-[[3-(methanesulfonamido)phenyl]methyl]-3-(1-phenylpyrazol-4-yl)propanamide Traditional Name: N-[3-(methanesulfonamido)benzyl]-3-(1-phenylpyrazol-4-yl)propionamide Formula: C20H22N4O3S MolecularWeight: 398.47868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)CNC(=O)CCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)CNC(=O)CCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3S/c1-28(26,27)23-18-7-5-6-16(12-18)13-21-20(25)11-10-17-14-22-24(15-17)19-8-3-2-4-9-19/h2-9,12,14-15,23H,10-11,13H2,1H3,(H,21,25)