1-(4-methylphenyl)-3-[[2-(3-oxidanylidene-4-pyridin-3-yl-1H-pyrazol-2-yl)pyridin-4-yl]methyl]urea

Systemtic Name: 1-(4-methylphenyl)-3-[[2-(3-oxidanylidene-4-pyridin-3-yl-1H-pyrazol-2-yl)pyridin-4-yl]methyl]urea Openeye Name: 1-[[2-[3-oxo-4-(3-pyridyl)-1H-pyrazol-2-yl]-4-pyridyl]methyl]-3-(p-tolyl)urea CAS Name: 1-(4-methylphenyl)-3-[[2-[3-oxo-4-(3-pyridinyl)-1H-pyrazol-2-yl]-4-pyridinyl]methyl]urea IUPAC Name: 1-(4-methylphenyl)-3-[[2-(3-oxo-4-pyridin-3-yl-1H-pyrazol-2-yl)pyridin-4-yl]methyl]urea Traditional Name: 1-[[2-[5-keto-4-(3-pyridyl)-3-pyrazolin-1-yl]-4-pyridyl]methyl]-3-(p-tolyl)urea Formula: C22H20N6O2 MolecularWeight: 400.4332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NCC2=CC(=NC=C2)N3C(=O)C(=CN3)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NCC2=CC(=NC=C2)N3C(=O)C(=CN3)C4=CN=CC=C4

InChI

InChI=1S/C22H20N6O2/c1-15-4-6-18(7-5-15)27-22(30)25-12-16-8-10-24-20(11-16)28-21(29)19(14-26-28)17-3-2-9-23-13-17/h2-11,13-14,26H,12H2,1H3,(H2,25,27,30)