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

Systemtic Name: 1-[2-[2-[5-azanyl-3-(4-chlorophenyl)-4-cyano-pyrazol-1-yl]-2-methyl-propyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea Openeye Name: 1-[2-[2-[5-amino-3-(4-chlorophenyl)-4-cyano-pyrazol-1-yl]-2-methyl-propyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea CAS Name: 1-[2-[2-[5-amino-3-(4-chlorophenyl)-4-cyano-1-pyrazolyl]-2-methylpropyl]phenyl]-3-(6-phenyl-3-pyridazinyl)urea IUPAC Name: 1-[2-[2-[5-amino-3-(4-chlorophenyl)-4-cyanopyrazol-1-yl]-2-methylpropyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea Traditional Name: 1-[2-[2-[5-amino-3-(4-chlorophenyl)-4-cyano-pyrazol-1-yl]-2-methyl-propyl]phenyl]-3-(6-phenylpyridazin-3-yl)urea Formula: C31H27ClN8O MolecularWeight: 563.05208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=CC=C1NC(=O)NC2=NN=C(C=C2)C3=CC=CC=C3)N4C(=C(C(=N4)C5=CC=C(C=C5)Cl)C#N)N

Isomeric SMILES

CC(C)(CC1=CC=CC=C1NC(=O)NC2=NN=C(C=C2)C3=CC=CC=C3)N4C(=C(C(=N4)C5=CC=C(C=C5)Cl)C#N)N

InChI

InChI=1S/C31H27ClN8O/c1-31(2,40-29(34)24(19-33)28(39-40)21-12-14-23(32)15-13-21)18-22-10-6-7-11-25(22)35-30(41)36-27-17-16-26(37-38-27)20-8-4-3-5-9-20/h3-17H,18,34H2,1-2H3,(H2,35,36,38,41)