N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-(3-fluoranyl-4-methoxy-phenyl)-1,2,4-triazin-3-amine

Systemtic Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-(3-fluoranyl-4-methoxy-phenyl)-1,2,4-triazin-3-amine Openeye Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-(3-fluoro-4-methoxy-phenyl)-1,2,4-triazin-3-amine CAS Name: N-[(1,5-dimethyl-4-pyrazolyl)methyl]-5-(3-fluoro-4-methoxyphenyl)-1,2,4-triazin-3-amine IUPAC Name: N-[(1,5-dimethylpyrazol-4-yl)methyl]-5-(3-fluoro-4-methoxyphenyl)-1,2,4-triazin-3-amine Traditional Name: (1,5-dimethylpyrazol-4-yl)methyl-[5-(3-fluoro-4-methoxy-phenyl)-1,2,4-triazin-3-yl]amine Formula: C16H17FN6O MolecularWeight: 328.344183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)CNC2=NC(=CN=N2)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC1=C(C=NN1C)CNC2=NC(=CN=N2)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C16H17FN6O/c1-10-12(8-20-23(10)2)7-18-16-21-14(9-19-22-16)11-4-5-15(24-3)13(17)6-11/h4-6,8-9H,7H2,1-3H3,(H,18,21,22)