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

Systemtic Name: N-(furan-2-ylmethyl)-1-methyl-4-[2-(4-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Openeye Name: N-(2-furylmethyl)-1-methyl-4-[2-(4-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide CAS Name: N-(2-furanylmethyl)-1-methyl-4-[[2-(4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-3-pyrazolecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-1-methyl-4-[2-(4-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Traditional Name: N-(2-furfuryl)-1-methyl-4-[2-(4-nitropyrazol-1-yl)propanoylamino]pyrazole-3-carboxamide Formula: C16H17N7O5 MolecularWeight: 387.35008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CN(N=C1C(=O)NCC2=CC=CO2)C)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CN(N=C1C(=O)NCC2=CC=CO2)C)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N7O5/c1-10(22-8-11(6-18-22)23(26)27)15(24)19-13-9-21(2)20-14(13)16(25)17-7-12-4-3-5-28-12/h3-6,8-10H,7H2,1-2H3,(H,17,25)(H,19,24)