2-methyl-N-[(1-methylpyrazol-4-yl)methyl]-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide

Systemtic Name: 2-methyl-N-[(1-methylpyrazol-4-yl)methyl]-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Openeye Name: 2-methyl-N-[(1-methylpyrazol-4-yl)methyl]-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide CAS Name: 2-methyl-N-[(1-methyl-4-pyrazolyl)methyl]-4-[[3-(3-nitro-1-pyrazolyl)-1-oxopropyl]amino]-3-pyrazolecarboxamide IUPAC Name: 2-methyl-N-[(1-methylpyrazol-4-yl)methyl]-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Traditional Name: 2-methyl-N-[(1-methylpyrazol-4-yl)methyl]-4-[3-(3-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Formula: C16H19N9O4 MolecularWeight: 401.37996

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CNC(=O)C2=C(C=NN2C)NC(=O)CCN3C=CC(=N3)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=N1)CNC(=O)C2=C(C=NN2C)NC(=O)CCN3C=CC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N9O4/c1-22-10-11(8-18-22)7-17-16(27)15-12(9-19-23(15)2)20-14(26)4-6-24-5-3-13(21-24)25(28)29/h3,5,8-10H,4,6-7H2,1-2H3,(H,17,27)(H,20,26)