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

Systemtic Name: N-[3-(furan-2-ylmethylcarbamoyl)-1-methyl-pyrazol-4-yl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[3-(2-furylmethylcarbamoyl)-1-methyl-pyrazol-4-yl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[3-[(2-furanylmethylamino)-oxomethyl]-1-methyl-4-pyrazolyl]-1,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[3-(furan-2-ylmethylcarbamoyl)-1-methylpyrazol-4-yl]-1,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[3-(2-furfurylcarbamoyl)-1-methyl-pyrazol-4-yl]-1,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C16H17N7O5 MolecularWeight: 387.35008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)NC2=CN(N=C2C(=O)NCC3=CC=CO3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)NC2=CN(N=C2C(=O)NCC3=CC=CO3)C)[N+](=O)[O-]

InChI

InChI=1S/C16H17N7O5/c1-9-14(23(26)27)13(20-22(9)3)16(25)18-11-8-21(2)19-12(11)15(24)17-7-10-5-4-6-28-10/h4-6,8H,7H2,1-3H3,(H,17,24)(H,18,25)