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

Systemtic Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-2-(5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2-(5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-2-(5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C20H24N6O3 MolecularWeight: 396.44296

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=C(N(N=C1C)C2=CC=CC=C2)C)N3C(=CC(=N3)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NCC1=C(N(N=C1C)C2=CC=CC=C2)C)N3C(=CC(=N3)[N+](=O)[O-])C

InChI

InChI=1S/C20H24N6O3/c1-5-18(24-13(2)11-19(23-24)26(28)29)20(27)21-12-17-14(3)22-25(15(17)4)16-9-7-6-8-10-16/h6-11,18H,5,12H2,1-4H3,(H,21,27)