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

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-4-yl]-1-(3-methoxy-4-phenylmethoxy-phenyl)methanimine Openeye Name: 1-(4-benzyloxy-3-methoxy-phenyl)-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-methoxy-4-phenylmethoxyphenyl)methanimine IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-4-yl]-1-(3-methoxy-4-phenylmethoxyphenyl)methanimine Traditional Name: (Z)-(4-benzoxy-3-methoxy-benzylidene)-[3-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-4-yl]amine Formula: C22H22N6O2 MolecularWeight: 402.44908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N6O2/c1-16-11-17(2)28(26-16)22-25-23-15-27(22)24-13-19-9-10-20(21(12-19)29-3)30-14-18-7-5-4-6-8-18/h4-13,15H,14H2,1-3H3/b24-13-