1-(3-chlorophenyl)-5-ethyl-N-[4-(2-methylpropanoylamino)phenyl]pyrazole-4-carboxamide

Systemtic Name: 1-(3-chlorophenyl)-5-ethyl-N-[4-(2-methylpropanoylamino)phenyl]pyrazole-4-carboxamide Openeye Name: 1-(3-chlorophenyl)-5-ethyl-N-[4-(2-methylpropanoylamino)phenyl]pyrazole-4-carboxamide CAS Name: 1-(3-chlorophenyl)-5-ethyl-N-[4-[(2-methyl-1-oxopropyl)amino]phenyl]-4-pyrazolecarboxamide IUPAC Name: 1-(3-chlorophenyl)-5-ethyl-N-[4-(2-methylpropanoylamino)phenyl]pyrazole-4-carboxamide Traditional Name: 1-(3-chlorophenyl)-5-ethyl-N-[4-(isobutyrylamino)phenyl]pyrazole-4-carboxamide Formula: C22H23ClN4O2 MolecularWeight: 410.89662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NC3=CC=C(C=C3)NC(=O)C(C)C

Isomeric SMILES

CCC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)NC3=CC=C(C=C3)NC(=O)C(C)C

InChI

InChI=1S/C22H23ClN4O2/c1-4-20-19(13-24-27(20)18-7-5-6-15(23)12-18)22(29)26-17-10-8-16(9-11-17)25-21(28)14(2)3/h5-14H,4H2,1-3H3,(H,25,28)(H,26,29)