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

Systemtic Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-4-(5-methyl-3-nitro-pyrazol-1-yl)butanamide Openeye Name: N-[3,5-dimethyl-1-(o-tolylmethyl)pyrazol-4-yl]-4-(5-methyl-3-nitro-pyrazol-1-yl)butanamide CAS Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]-4-pyrazolyl]-4-(5-methyl-3-nitro-1-pyrazolyl)butanamide IUPAC Name: N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]-4-(5-methyl-3-nitropyrazol-1-yl)butanamide Traditional Name: N-[3,5-dimethyl-1-(2-methylbenzyl)pyrazol-4-yl]-4-(5-methyl-3-nitro-pyrazol-1-yl)butyramide Formula: C21H26N6O3 MolecularWeight: 410.46954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N6O3/c1-14-8-5-6-9-18(14)13-26-17(4)21(16(3)23-26)22-20(28)10-7-11-25-15(2)12-19(24-25)27(29)30/h5-6,8-9,12H,7,10-11,13H2,1-4H3,(H,22,28)