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

Systemtic Name: 1-[2-[[4-(4-bromophenyl)-5-cyano-pyrimidin-2-yl]amino]phenyl]-2-(6-phenylpyridazin-3-yl)guanidine Openeye Name: 1-[2-[[4-(4-bromophenyl)-5-cyano-pyrimidin-2-yl]amino]phenyl]-2-(6-phenylpyridazin-3-yl)guanidine CAS Name: 1-[2-[[4-(4-bromophenyl)-5-cyano-2-pyrimidinyl]amino]phenyl]-2-(6-phenyl-3-pyridazinyl)guanidine IUPAC Name: 1-[2-[[4-(4-bromophenyl)-5-cyanopyrimidin-2-yl]amino]phenyl]-2-(6-phenylpyridazin-3-yl)guanidine Traditional Name: 1-[2-[[4-(4-bromophenyl)-5-cyano-pyrimidin-2-yl]amino]phenyl]-2-(6-phenylpyridazin-3-yl)guanidine Formula: C28H20BrN9 MolecularWeight: 562.4227

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C28H20BrN9/c29-21-12-10-19(11-13-21)26-20(16-30)17-32-28(36-26)34-24-9-5-4-8-23(24)33-27(31)35-25-15-14-22(37-38-25)18-6-2-1-3-7-18/h1-15,17H,(H,32,34,36)(H3,31,33,35,38)