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

Systemtic Name: 1-(4-fluorophenyl)-N-[2-[(4-nitrophenyl)amino]ethyl]-5-propan-2-yl-pyrazole-4-carboxamide Openeye Name: 1-(4-fluorophenyl)-5-isopropyl-N-[2-(4-nitroanilino)ethyl]pyrazole-4-carboxamide CAS Name: 1-(4-fluorophenyl)-N-[2-(4-nitroanilino)ethyl]-5-propan-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-(4-fluorophenyl)-N-[2-(4-nitroanilino)ethyl]-5-propan-2-ylpyrazole-4-carboxamide Traditional Name: 1-(4-fluorophenyl)-5-isopropyl-N-[2-(4-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=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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