N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-1,2,4-triazol-3-yl]-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-1,2,4-triazol-3-yl]-1-methyl-pyrazole-3-carboxamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenyl)methyl]-1,2,4-triazol-3-yl]-1-methyl-pyrazole-3-carboxamide CAS Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-1,2,4-triazol-3-yl]-1-methylpyrazole-3-carboxamide Traditional Name: N-[1-(2-chloro-4-fluoro-benzyl)-1,2,4-triazol-3-yl]-1-methyl-pyrazole-3-carboxamide Formula: C14H12ClFN6O MolecularWeight: 334.736083

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)C(=O)NC2=NN(C=N2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CN1C=CC(=N1)C(=O)NC2=NN(C=N2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C14H12ClFN6O/c1-21-5-4-12(19-21)13(23)18-14-17-8-22(20-14)7-9-2-3-10(16)6-11(9)15/h2-6,8H,7H2,1H3,(H,18,20,23)