4-[2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)ethanoylamino]-N-(1,5-dimethylpyrazol-4-yl)-2-ethyl-pyrazole-3-carboxamide

Systemtic Name: 4-[2-(4-bromanyl-5-methyl-3-nitro-pyrazol-1-yl)ethanoylamino]-N-(1,5-dimethylpyrazol-4-yl)-2-ethyl-pyrazole-3-carboxamide Openeye Name: 4-[[2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)acetyl]amino]-N-(1,5-dimethylpyrazol-4-yl)-2-ethyl-pyrazole-3-carboxamide CAS Name: 4-[[2-(4-bromo-5-methyl-3-nitro-1-pyrazolyl)-1-oxoethyl]amino]-N-(1,5-dimethyl-4-pyrazolyl)-2-ethyl-3-pyrazolecarboxamide IUPAC Name: 4-[[2-(4-bromo-5-methyl-3-nitropyrazol-1-yl)acetyl]amino]-N-(1,5-dimethylpyrazol-4-yl)-2-ethylpyrazole-3-carboxamide Traditional Name: 4-[[2-(4-bromo-5-methyl-3-nitro-pyrazol-1-yl)acetyl]amino]-N-(1,5-dimethylpyrazol-4-yl)-2-ethyl-pyrazole-3-carboxamide Formula: C17H20BrN9O4 MolecularWeight: 494.3026

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)NC(=O)CN2C(=C(C(=N2)[N+](=O)[O-])Br)C)C(=O)NC3=C(N(N=C3)C)C

Isomeric SMILES

CCN1C(=C(C=N1)NC(=O)CN2C(=C(C(=N2)[N+](=O)[O-])Br)C)C(=O)NC3=C(N(N=C3)C)C

InChI

InChI=1S/C17H20BrN9O4/c1-5-25-15(17(29)22-11-6-19-24(4)9(11)2)12(7-20-25)21-13(28)8-26-10(3)14(18)16(23-26)27(30)31/h6-7H,5,8H2,1-4H3,(H,21,28)(H,22,29)