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

Systemtic Name: N-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]-4-(5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-4-(5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: N-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]-4-(5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-(1-benzyl-3,5-dimethylpyrazol-4-yl)-4-(5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)-4-(5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C20H24N6O3 MolecularWeight: 396.44296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N6O3/c1-14-12-18(26(28)29)23-24(14)11-7-10-19(27)21-20-15(2)22-25(16(20)3)13-17-8-5-4-6-9-17/h4-6,8-9,12H,7,10-11,13H2,1-3H3,(H,21,27)