4-(acetamidomethyl)-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide

Systemtic Name: 4-(acetamidomethyl)-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide Openeye Name: 4-(acetamidomethyl)-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide CAS Name: 4-(acetamidomethyl)-N-[3-[[1-oxo-2-(1-pyrazolyl)propyl]amino]phenyl]benzamide IUPAC Name: 4-(acetamidomethyl)-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide Traditional Name: 4-(acetamidomethyl)-N-[3-(2-pyrazol-1-ylpropanoylamino)phenyl]benzamide Formula: C22H23N5O3 MolecularWeight: 405.44972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)CNC(=O)C)N3C=CC=N3

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)NC(=O)C2=CC=C(C=C2)CNC(=O)C)N3C=CC=N3

InChI

InChI=1S/C22H23N5O3/c1-15(27-12-4-11-24-27)21(29)25-19-5-3-6-20(13-19)26-22(30)18-9-7-17(8-10-18)14-23-16(2)28/h3-13,15H,14H2,1-2H3,(H,23,28)(H,25,29)(H,26,30)