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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCC2=CC=CO2)NC(=O)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCC2=CC=CO2)NC(=O)CN3C=C(C=N3)[N+](=O)[O-]

InChI

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