5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(1,2,4-triazol-4-yl)furan-2-carboxamide

Systemtic Name: 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(1,2,4-triazol-4-yl)furan-2-carboxamide Openeye Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(1,2,4-triazol-4-yl)furan-2-carboxamide CAS Name: 5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-N-(1,2,4-triazol-4-yl)-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-(1,2,4-triazol-4-yl)furan-2-carboxamide Traditional Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-N-(1,2,4-triazol-4-yl)-2-furamide Formula: C13H13BrN6O2 MolecularWeight: 365.18532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NN3C=NN=C3)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NN3C=NN=C3)C)Br

InChI

InChI=1S/C13H13BrN6O2/c1-8-12(14)9(2)20(17-8)5-10-3-4-11(22-10)13(21)18-19-6-15-16-7-19/h3-4,6-7H,5H2,1-2H3,(H,18,21)