1-[2-[2-[5-azanyl-4-cyano-3-(4-methylphenyl)pyrazol-1-yl]-2-methyl-propyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea

Systemtic Name: 1-[2-[2-[5-azanyl-4-cyano-3-(4-methylphenyl)pyrazol-1-yl]-2-methyl-propyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea Openeye Name: 1-[2-[2-[5-amino-4-cyano-3-(p-tolyl)pyrazol-1-yl]-2-methyl-propyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea CAS Name: 1-[2-[2-[5-amino-4-cyano-3-(4-methylphenyl)-1-pyrazolyl]-2-methylpropyl]phenyl]-3-(6-phenyl-3-pyridazinyl)urea IUPAC Name: 1-[2-[2-[5-amino-4-cyano-3-(4-methylphenyl)pyrazol-1-yl]-2-methylpropyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea Traditional Name: 1-[2-[2-[5-amino-4-cyano-3-(p-tolyl)pyrazol-1-yl]-2-methyl-propyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea Formula: C32H30N8O MolecularWeight: 542.6336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=C2C#N)N)C(C)(C)CC3=CC=CC=C3NC(=O)NC4=NN=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=C2C#N)N)C(C)(C)CC3=CC=CC=C3NC(=O)NC4=NN=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H30N8O/c1-21-13-15-23(16-14-21)29-25(20-33)30(34)40(39-29)32(2,3)19-24-11-7-8-12-26(24)35-31(41)36-28-18-17-27(37-38-28)22-9-5-4-6-10-22/h4-18H,19,34H2,1-3H3,(H2,35,36,38,41)