1-ethyl-4-[2-(5-methyl-3-nitro-pyrazol-1-yl)butanoylamino]-N-(2-methylpropyl)pyrazole-3-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CN(N=C1C(=O)NCC(C)C)CC)N2C(=CC(=N2)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NC1=CN(N=C1C(=O)NCC(C)C)CC)N2C(=CC(=N2)[N+](=O)[O-])C

InChI

InChI=1S/C18H27N7O4/c1-6-14(24-12(5)8-15(21-24)25(28)29)17(26)20-13-10-23(7-2)22-16(13)18(27)19-9-11(3)4/h8,10-11,14H,6-7,9H2,1-5H3,(H,19,27)(H,20,26)