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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(N(N=C1C)CC2=CC=CC=C2C)C)N3C(=CC(=N3)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NC1=C(N(N=C1C)CC2=CC=CC=C2C)C)N3C(=CC(=N3)[N+](=O)[O-])C

InChI

InChI=1S/C21H26N6O3/c1-6-18(26-14(3)11-19(24-26)27(29)30)21(28)22-20-15(4)23-25(16(20)5)12-17-10-8-7-9-13(17)2/h7-11,18H,6,12H2,1-5H3,(H,22,28)