3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]-2-methyl-propanamide

Systemtic Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]-2-methyl-propanamide Openeye Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]-2-methyl-propanamide CAS Name: 3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[1-[(3-fluorophenyl)methyl]-4-pyrazolyl]-2-methylpropanamide IUPAC Name: 3-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[1-[(3-fluorophenyl)methyl]pyrazol-4-yl]-2-methylpropanamide Traditional Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-(3-fluorobenzyl)pyrazol-4-yl]-2-methyl-propionamide Formula: C19H21FN6O3 MolecularWeight: 400.406843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(C)C(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)F)C)[N+](=O)[O-]

InChI

InChI=1S/C19H21FN6O3/c1-12(9-25-14(3)18(26(28)29)13(2)23-25)19(27)22-17-8-21-24(11-17)10-15-5-4-6-16(20)7-15/h4-8,11-12H,9-10H2,1-3H3,(H,22,27)