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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCC(=O)NC2=C(N(N=C2C)CC3=CC=C(C=C3)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CCCC(=O)NC2=C(N(N=C2C)CC3=CC=C(C=C3)F)C)[N+](=O)[O-]

InChI

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