1-(4-fluorophenyl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-5-propan-2-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-5-propan-2-yl-pyrazole-4-carboxamide Openeye Name: N-[2-(benzylamino)-2-oxo-ethyl]-1-(4-fluorophenyl)-5-isopropyl-pyrazole-4-carboxamide CAS Name: 1-(4-fluorophenyl)-N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-5-propan-2-yl-4-pyrazolecarboxamide IUPAC Name: N-[2-(benzylamino)-2-oxoethyl]-1-(4-fluorophenyl)-5-propan-2-ylpyrazole-4-carboxamide Traditional Name: N-[2-(benzylamino)-2-keto-ethyl]-1-(4-fluorophenyl)-5-isopropyl-pyrazole-4-carboxamide Formula: C22H23FN4O2 MolecularWeight: 394.442023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H23FN4O2/c1-15(2)21-19(13-26-27(21)18-10-8-17(23)9-11-18)22(29)25-14-20(28)24-12-16-6-4-3-5-7-16/h3-11,13,15H,12,14H2,1-2H3,(H,24,28)(H,25,29)