2-[2-[[5-(2-methylphenyl)-1,2,4-triazin-3-yl]amino]ethyl]-6-phenyl-pyridazin-3-one

Systemtic Name: 2-[2-[[5-(2-methylphenyl)-1,2,4-triazin-3-yl]amino]ethyl]-6-phenyl-pyridazin-3-one Openeye Name: 2-[2-[[5-(o-tolyl)-1,2,4-triazin-3-yl]amino]ethyl]-6-phenyl-pyridazin-3-one CAS Name: 2-[2-[[5-(2-methylphenyl)-1,2,4-triazin-3-yl]amino]ethyl]-6-phenyl-3-pyridazinone IUPAC Name: 2-[2-[[5-(2-methylphenyl)-1,2,4-triazin-3-yl]amino]ethyl]-6-phenylpyridazin-3-one Traditional Name: 2-[2-[[5-(o-tolyl)-1,2,4-triazin-3-yl]amino]ethyl]-6-phenyl-pyridazin-3-one Formula: C22H20N6O MolecularWeight: 384.4338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CN=NC(=N2)NCCN3C(=O)C=CC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C2=CN=NC(=N2)NCCN3C(=O)C=CC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C22H20N6O/c1-16-7-5-6-10-18(16)20-15-24-26-22(25-20)23-13-14-28-21(29)12-11-19(27-28)17-8-3-2-4-9-17/h2-12,15H,13-14H2,1H3,(H,23,25,26)