3-[(4-bromanylpyrazol-1-yl)methyl]-N-[2-(pyrazin-2-ylcarbonylamino)ethyl]-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: 3-[(4-bromanylpyrazol-1-yl)methyl]-N-[2-(pyrazin-2-ylcarbonylamino)ethyl]-1,2,4-oxadiazole-5-carboxamide Openeye Name: 3-[(4-bromopyrazol-1-yl)methyl]-N-[2-(pyrazine-2-carbonylamino)ethyl]-1,2,4-oxadiazole-5-carboxamide CAS Name: 3-[(4-bromo-1-pyrazolyl)methyl]-N-[2-[[oxo(2-pyrazinyl)methyl]amino]ethyl]-1,2,4-oxadiazole-5-carboxamide IUPAC Name: 3-[(4-bromopyrazol-1-yl)methyl]-N-[2-(pyrazine-2-carbonylamino)ethyl]-1,2,4-oxadiazole-5-carboxamide Traditional Name: 3-[(4-bromopyrazol-1-yl)methyl]-N-[2-(pyrazinoylamino)ethyl]-1,2,4-oxadiazole-5-carboxamide Formula: C14H13BrN8O3 MolecularWeight: 421.20882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C=N1)C(=O)NCCNC(=O)C2=NC(=NO2)CN3C=C(C=N3)Br

Isomeric SMILES

C1=CN=C(C=N1)C(=O)NCCNC(=O)C2=NC(=NO2)CN3C=C(C=N3)Br

InChI

InChI=1S/C14H13BrN8O3/c15-9-5-20-23(7-9)8-11-21-14(26-22-11)13(25)19-4-3-18-12(24)10-6-16-1-2-17-10/h1-2,5-7H,3-4,8H2,(H,18,24)(H,19,25)