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

Systemtic Name: 1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]pyrazole-3-carboxamide Openeye Name: 1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[1-(o-tolylmethyl)pyrazol-3-yl]pyrazole-3-carboxamide CAS Name: 1-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[1-[(2-methylphenyl)methyl]-3-pyrazolyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-[1-[(2-methylphenyl)methyl]pyrazol-3-yl]pyrazole-3-carboxamide Traditional Name: 1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[1-(2-methylbenzyl)pyrazol-3-yl]pyrazole-3-carboxamide Formula: C21H22N8O3 MolecularWeight: 434.45118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC(=N2)NC(=O)C3=NN(C=C3)CN4C(=C(C(=N4)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC(=N2)NC(=O)C3=NN(C=C3)CN4C(=C(C(=N4)C)[N+](=O)[O-])C

InChI

InChI=1S/C21H22N8O3/c1-14-6-4-5-7-17(14)12-26-11-9-19(25-26)22-21(30)18-8-10-27(24-18)13-28-16(3)20(29(31)32)15(2)23-28/h4-11H,12-13H2,1-3H3,(H,22,25,30)