N-[[3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-1-(1H-pyrazol-5-yl)methanamine

Systemtic Name: N-[[3-(2-fluoranyl-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-1-(1H-pyrazol-5-yl)methanamine Openeye Name: N-[[3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl]-N-methyl-1-(1H-pyrazol-5-yl)methanamine CAS Name: N-[[3-(2-fluoro-4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methyl]-N-methyl-1-(1H-pyrazol-5-yl)methanamine IUPAC Name: N-[[3-(2-fluoro-4-methoxyphenyl)-1-phenylpyrazol-4-yl]methyl]-N-methyl-1-(1H-pyrazol-5-yl)methanamine Traditional Name: [3-(2-fluoro-4-methoxy-phenyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-(1H-pyrazol-5-ylmethyl)amine Formula: C22H22FN5O MolecularWeight: 391.441383

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=NN1)CC2=CN(N=C2C3=C(C=C(C=C3)OC)F)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=NN1)CC2=CN(N=C2C3=C(C=C(C=C3)OC)F)C4=CC=CC=C4

InChI

InChI=1S/C22H22FN5O/c1-27(15-17-10-11-24-25-17)13-16-14-28(18-6-4-3-5-7-18)26-22(16)20-9-8-19(29-2)12-21(20)23/h3-12,14H,13,15H2,1-2H3,(H,24,25)