1-ethyl-N-(2-methylpropyl)-4-[[1-[(2-nitrophenoxy)methyl]pyrazol-3-yl]carbonylamino]pyrazole-3-carboxamide

Systemtic Name: 1-ethyl-N-(2-methylpropyl)-4-[[1-[(2-nitrophenoxy)methyl]pyrazol-3-yl]carbonylamino]pyrazole-3-carboxamide Openeye Name: 1-ethyl-N-isobutyl-4-[[1-[(2-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]pyrazole-3-carboxamide CAS Name: 1-ethyl-N-(2-methylpropyl)-4-[[[1-[(2-nitrophenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]-3-pyrazolecarboxamide IUPAC Name: 1-ethyl-N-(2-methylpropyl)-4-[[1-[(2-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]pyrazole-3-carboxamide Traditional Name: 1-ethyl-N-isobutyl-4-[[1-[(2-nitrophenoxy)methyl]pyrazole-3-carbonyl]amino]pyrazole-3-carboxamide Formula: C21H25N7O5 MolecularWeight: 455.4671

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H25N7O5/c1-4-26-12-16(19(25-26)21(30)22-11-14(2)3)23-20(29)15-9-10-27(24-15)13-33-18-8-6-5-7-17(18)28(31)32/h5-10,12,14H,4,11,13H2,1-3H3,(H,22,30)(H,23,29)