1-[2-[[4-(4-bromophenyl)-5-cyano-pyrimidin-2-yl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)urea

Systemtic Name: 1-[2-[[4-(4-bromophenyl)-5-cyano-pyrimidin-2-yl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)urea Openeye Name: 1-[2-[[4-(4-bromophenyl)-5-cyano-pyrimidin-2-yl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)urea CAS Name: 1-[2-[[4-(4-bromophenyl)-5-cyano-2-pyrimidinyl]amino]phenyl]-3-(6-phenyl-3-pyridazinyl)urea IUPAC Name: 1-[2-[[4-(4-bromophenyl)-5-cyanopyrimidin-2-yl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)urea Traditional Name: 1-[2-[[4-(4-bromophenyl)-5-cyano-pyrimidin-2-yl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)urea Formula: C28H19BrN8O MolecularWeight: 563.40746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C=C2)NC(=O)NC3=CC=CC=C3NC4=NC=C(C(=N4)C5=CC=C(C=C5)Br)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C=C2)NC(=O)NC3=CC=CC=C3NC4=NC=C(C(=N4)C5=CC=C(C=C5)Br)C#N

InChI

InChI=1S/C28H19BrN8O/c29-21-12-10-19(11-13-21)26-20(16-30)17-31-27(35-26)32-23-8-4-5-9-24(23)33-28(38)34-25-15-14-22(36-37-25)18-6-2-1-3-7-18/h1-15,17H,(H,31,32,35)(H2,33,34,37,38)