N-butyl-6-(4-nitropyrazol-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: N-butyl-6-(4-nitropyrazol-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: N-butyl-6-(4-nitropyrazol-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: N-butyl-6-(4-nitro-1-pyrazolyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide IUPAC Name: N-butyl-6-(4-nitropyrazol-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: N-butyl-6-(4-nitropyrazol-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide Formula: C13H14N8O3 MolecularWeight: 330.30206

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=NN2C=C(C=NC2=N1)N3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)C1=NN2C=C(C=NC2=N1)N3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C13H14N8O3/c1-2-3-4-14-12(22)11-17-13-15-5-9(7-20(13)18-11)19-8-10(6-16-19)21(23)24/h5-8H,2-4H2,1H3,(H,14,22)