5-(1-benzofuran-2-yl)-N-[[1-(2-methylphenyl)pyrazol-4-yl]methyl]-1,2,4-triazin-3-amine

Systemtic Name: 5-(1-benzofuran-2-yl)-N-[[1-(2-methylphenyl)pyrazol-4-yl]methyl]-1,2,4-triazin-3-amine Openeye Name: 5-(benzofuran-2-yl)-N-[[1-(o-tolyl)pyrazol-4-yl]methyl]-1,2,4-triazin-3-amine CAS Name: 5-(2-benzofuranyl)-N-[[1-(2-methylphenyl)-4-pyrazolyl]methyl]-1,2,4-triazin-3-amine IUPAC Name: 5-(1-benzofuran-2-yl)-N-[[1-(2-methylphenyl)pyrazol-4-yl]methyl]-1,2,4-triazin-3-amine Traditional Name: [5-(benzofuran-2-yl)-1,2,4-triazin-3-yl]-[[1-(o-tolyl)pyrazol-4-yl]methyl]amine Formula: C22H18N6O MolecularWeight: 382.41792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=C(C=N2)CNC3=NC(=CN=N3)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CC1=CC=CC=C1N2C=C(C=N2)CNC3=NC(=CN=N3)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C22H18N6O/c1-15-6-2-4-8-19(15)28-14-16(12-25-28)11-23-22-26-18(13-24-27-22)21-10-17-7-3-5-9-20(17)29-21/h2-10,12-14H,11H2,1H3,(H,23,26,27)