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

Systemtic Name: N-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: N-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: N-[1-[(2-fluorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-2-(5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[1-[(2-fluorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-2-(5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-[1-(2-fluorobenzyl)-3,5-dimethyl-pyrazol-4-yl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C20H23FN6O3 MolecularWeight: 414.433423

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(N(N=C1C)CC2=CC=CC=C2F)C)N3C(=CC(=N3)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NC1=C(N(N=C1C)CC2=CC=CC=C2F)C)N3C(=CC(=N3)[N+](=O)[O-])C

InChI

InChI=1S/C20H23FN6O3/c1-5-17(26-12(2)10-18(24-26)27(29)30)20(28)22-19-13(3)23-25(14(19)4)11-15-8-6-7-9-16(15)21/h6-10,17H,5,11H2,1-4H3,(H,22,28)