4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide

Systemtic Name: 4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide Openeye Name: 4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]-1-ethyl-N-isobutyl-pyrazole-3-carboxamide CAS Name: 4-[[3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-1-ethyl-N-(2-methylpropyl)-3-pyrazolecarboxamide IUPAC Name: 4-[3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanoylamino]-1-ethyl-N-(2-methylpropyl)pyrazole-3-carboxamide Traditional Name: 4-[3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanoylamino]-1-ethyl-N-isobutyl-pyrazole-3-carboxamide Formula: C18H27N7O4 MolecularWeight: 405.45148

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)CCN2C(=C(C(=N2)C)[N+](=O)[O-])C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)CCN2C(=C(C(=N2)C)[N+](=O)[O-])C

InChI

InChI=1S/C18H27N7O4/c1-6-23-10-14(16(22-23)18(27)19-9-11(2)3)20-15(26)7-8-24-13(5)17(25(28)29)12(4)21-24/h10-11H,6-9H2,1-5H3,(H,19,27)(H,20,26)