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

Systemtic Name: 4-bromanyl-N-[1-[(3-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-1,5-dimethyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[1-[(3-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-1,5-dimethyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[1-[(3-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[1-[(3-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-1,5-dimethylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[1-(3-fluorobenzyl)-1,2,4-triazol-3-yl]-1,5-dimethyl-pyrazole-3-carboxamide Formula: C15H14BrFN6O MolecularWeight: 393.213663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)NC2=NN(C=N2)CC3=CC(=CC=C3)F)Br

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)NC2=NN(C=N2)CC3=CC(=CC=C3)F)Br

InChI

InChI=1S/C15H14BrFN6O/c1-9-12(16)13(20-22(9)2)14(24)19-15-18-8-23(21-15)7-10-4-3-5-11(17)6-10/h3-6,8H,7H2,1-2H3,(H,19,21,24)