1-(3-methylphenyl)-3-[4-[[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]amino]phenyl]urea

Systemtic Name: 1-(3-methylphenyl)-3-[4-[[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]amino]phenyl]urea Openeye Name: 1-[4-[[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]amino]phenyl]-3-(m-tolyl)urea CAS Name: 1-(3-methylphenyl)-3-[4-[[6-(3-methyl-1-pyrazolyl)-3-pyridazinyl]amino]phenyl]urea IUPAC Name: 1-(3-methylphenyl)-3-[4-[[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]amino]phenyl]urea Traditional Name: 1-[4-[[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]amino]phenyl]-3-(m-tolyl)urea Formula: C22H21N7O MolecularWeight: 399.44844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)NC3=NN=C(C=C3)N4C=CC(=N4)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=CC=C(C=C2)NC3=NN=C(C=C3)N4C=CC(=N4)C

InChI

InChI=1S/C22H21N7O/c1-15-4-3-5-19(14-15)25-22(30)24-18-8-6-17(7-9-18)23-20-10-11-21(27-26-20)29-13-12-16(2)28-29/h3-14H,1-2H3,(H,23,26)(H2,24,25,30)