1-(3,5-dimethylphenyl)-3-[4-[(6-pyrazol-1-ylpyridazin-3-yl)amino]phenyl]urea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[4-[(6-pyrazol-1-ylpyridazin-3-yl)amino]phenyl]urea Openeye Name: 1-(3,5-dimethylphenyl)-3-[4-[(6-pyrazol-1-ylpyridazin-3-yl)amino]phenyl]urea CAS Name: 1-(3,5-dimethylphenyl)-3-[4-[[6-(1-pyrazolyl)-3-pyridazinyl]amino]phenyl]urea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[4-[(6-pyrazol-1-ylpyridazin-3-yl)amino]phenyl]urea Traditional Name: 1-(3,5-dimethylphenyl)-3-[4-[(6-pyrazol-1-ylpyridazin-3-yl)amino]phenyl]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/c1-15-12-16(2)14-19(13-15)26-22(30)25-18-6-4-17(5-7-18)24-20-8-9-21(28-27-20)29-11-3-10-23-29/h3-14H,1-2H3,(H,24,27)(H2,25,26,30)