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

Systemtic Name: N-[4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]phenyl]-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]phenyl]-1-methyl-pyrazole-3-carboxamide CAS Name: N-[4-[[3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxopropyl]amino]phenyl]-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[4-[3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]phenyl]-1-methylpyrazole-3-carboxamide Traditional Name: N-[4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]phenyl]-1-methyl-pyrazole-3-carboxamide Formula: C19H21N7O4 MolecularWeight: 411.41454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NC2=CC=C(C=C2)NC(=O)C3=NN(C=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NC2=CC=C(C=C2)NC(=O)C3=NN(C=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H21N7O4/c1-12-18(26(29)30)13(2)25(22-12)11-9-17(27)20-14-4-6-15(7-5-14)21-19(28)16-8-10-24(3)23-16/h4-8,10H,9,11H2,1-3H3,(H,20,27)(H,21,28)