1-(4-fluorophenyl)-5-methyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]pyrazole-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-5-methyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]pyrazole-4-carboxamide Openeye Name: N-[4-(allylcarbamoylamino)phenyl]-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide CAS Name: 1-(4-fluorophenyl)-5-methyl-N-[4-[[oxo-(prop-2-enylamino)methyl]amino]phenyl]-4-pyrazolecarboxamide IUPAC Name: 1-(4-fluorophenyl)-5-methyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]pyrazole-4-carboxamide Traditional Name: N-[4-(allylcarbamoylamino)phenyl]-1-(4-fluorophenyl)-5-methyl-pyrazole-4-carboxamide Formula: C21H20FN5O2 MolecularWeight: 393.414203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NC3=CC=C(C=C3)NC(=O)NCC=C

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NC3=CC=C(C=C3)NC(=O)NCC=C

InChI

InChI=1S/C21H20FN5O2/c1-3-12-23-21(29)26-17-8-6-16(7-9-17)25-20(28)19-13-24-27(14(19)2)18-10-4-15(22)5-11-18/h3-11,13H,1,12H2,2H3,(H,25,28)(H2,23,26,29)