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

Systemtic Name: 1-(4-butoxy-3-ethoxy-phenyl)-N-[3-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-4-yl]methanimine Openeye Name: 1-(4-butoxy-3-ethoxy-phenyl)-N-[3-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-4-yl]methanimine CAS Name: 1-(4-butoxy-3-ethoxyphenyl)-N-[3-(3,5-dimethyl-1-pyrazolyl)-1,2,4-triazol-4-yl]methanimine IUPAC Name: 1-(4-butoxy-3-ethoxyphenyl)-N-[3-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-4-yl]methanimine Traditional Name: (Z)-(4-butoxy-3-ethoxy-benzylidene)-[3-(3,5-dimethylpyrazol-1-yl)-1,2,4-triazol-4-yl]amine Formula: C20H26N6O2 MolecularWeight: 382.45944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=NN2C=NN=C2N3C(=CC(=N3)C)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=N\N2C=NN=C2N3C(=CC(=N3)C)C)OCC

InChI

InChI=1S/C20H26N6O2/c1-5-7-10-28-18-9-8-17(12-19(18)27-6-2)13-22-25-14-21-23-20(25)26-16(4)11-15(3)24-26/h8-9,11-14H,5-7,10H2,1-4H3/b22-13-