5-(3,4-dimethoxyphenyl)-N-[(3-phenyl-1H-pyrazol-5-yl)methyl]-1,2,4-triazin-3-amine

Systemtic Name: 5-(3,4-dimethoxyphenyl)-N-[(3-phenyl-1H-pyrazol-5-yl)methyl]-1,2,4-triazin-3-amine Openeye Name: 5-(3,4-dimethoxyphenyl)-N-[(3-phenyl-1H-pyrazol-5-yl)methyl]-1,2,4-triazin-3-amine CAS Name: 5-(3,4-dimethoxyphenyl)-N-[(3-phenyl-1H-pyrazol-5-yl)methyl]-1,2,4-triazin-3-amine IUPAC Name: 5-(3,4-dimethoxyphenyl)-N-[(3-phenyl-1H-pyrazol-5-yl)methyl]-1,2,4-triazin-3-amine Traditional Name: [5-(3,4-dimethoxyphenyl)-1,2,4-triazin-3-yl]-[(3-phenyl-1H-pyrazol-5-yl)methyl]amine Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN=NC(=N2)NCC3=CC(=NN3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN=NC(=N2)NCC3=CC(=NN3)C4=CC=CC=C4)OC

InChI

InChI=1S/C21H20N6O2/c1-28-19-9-8-15(10-20(19)29-2)18-13-23-27-21(24-18)22-12-16-11-17(26-25-16)14-6-4-3-5-7-14/h3-11,13H,12H2,1-2H3,(H,25,26)(H,22,24,27)