N-[3-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-4-yl]-1-(3-phenylmethoxyphenyl)methanimine

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-4-yl]-1-(3-phenylmethoxyphenyl)methanimine Openeye Name: 1-(3-benzyloxyphenyl)-N-[3-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-4-yl]methanimine CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)-1,2,4-triazol-4-yl]-1-(3-phenylmethoxyphenyl)methanimine IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-4-yl]-1-(3-phenylmethoxyphenyl)methanimine Traditional Name: (Z)-(3-benzoxybenzylidene)-[3-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-4-yl]amine Formula: C21H20N6O MolecularWeight: 372.4231

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=CN2N=CC3=CC(=CC=C3)OCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=CN2/N=C\C3=CC(=CC=C3)OCC4=CC=CC=C4)C

InChI

InChI=1S/C21H20N6O/c1-16-11-17(2)27(25-16)21-24-22-15-26(21)23-13-19-9-6-10-20(12-19)28-14-18-7-4-3-5-8-18/h3-13,15H,14H2,1-2H3/b23-13-