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

Systemtic Name: 1-(4-fluorophenyl)-N-[2-[(2-nitrophenyl)amino]ethyl]-5-propan-2-yl-pyrazole-4-carboxamide Openeye Name: 1-(4-fluorophenyl)-5-isopropyl-N-[2-(2-nitroanilino)ethyl]pyrazole-4-carboxamide CAS Name: 1-(4-fluorophenyl)-N-[2-(2-nitroanilino)ethyl]-5-propan-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-(4-fluorophenyl)-N-[2-(2-nitroanilino)ethyl]-5-propan-2-ylpyrazole-4-carboxamide Traditional Name: 1-(4-fluorophenyl)-5-isopropyl-N-[2-(2-nitroanilino)ethyl]pyrazole-4-carboxamide Formula: C21H22FN5O3 MolecularWeight: 411.429483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NCCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H22FN5O3/c1-14(2)20-17(13-25-26(20)16-9-7-15(22)8-10-16)21(28)24-12-11-23-18-5-3-4-6-19(18)27(29)30/h3-10,13-14,23H,11-12H2,1-2H3,(H,24,28)