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

Systemtic Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butanamide Openeye Name: 4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[3,5-dimethyl-1-(o-tolylmethyl)pyrazol-4-yl]butanamide CAS Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]-4-pyrazolyl]-4-(3,5-dimethyl-4-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-4-(3,5-dimethyl-4-nitropyrazol-1-yl)butanamide Traditional Name: N-[3,5-dimethyl-1-(2-methylbenzyl)pyrazol-4-yl]-4-(3,5-dimethyl-4-nitro-pyrazol-1-yl)butyramide Formula: C22H28N6O3 MolecularWeight: 424.49612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)CCCN3C(=C(C(=N3)C)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)CCCN3C(=C(C(=N3)C)[N+](=O)[O-])C)C

InChI

InChI=1S/C22H28N6O3/c1-14-9-6-7-10-19(14)13-27-17(4)21(15(2)24-27)23-20(29)11-8-12-26-18(5)22(28(30)31)16(3)25-26/h6-7,9-10H,8,11-13H2,1-5H3,(H,23,29)