N-(1-phenylethyl)-4-[5-(6-phenylpyridazin-3-yl)benzimidazol-1-yl]pyrimidin-2-amine

Systemtic Name: N-(1-phenylethyl)-4-[5-(6-phenylpyridazin-3-yl)benzimidazol-1-yl]pyrimidin-2-amine Openeye Name: N-(1-phenylethyl)-4-[5-(6-phenylpyridazin-3-yl)benzimidazol-1-yl]pyrimidin-2-amine CAS Name: N-(1-phenylethyl)-4-[5-(6-phenyl-3-pyridazinyl)-1-benzimidazolyl]-2-pyrimidinamine IUPAC Name: N-(1-phenylethyl)-4-[5-(6-phenylpyridazin-3-yl)benzimidazol-1-yl]pyrimidin-2-amine Traditional Name: 1-phenylethyl-[4-[5-(6-phenylpyridazin-3-yl)benzimidazol-1-yl]pyrimidin-2-yl]amine Formula: C29H23N7 MolecularWeight: 469.53982

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)C5=NN=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)C5=NN=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C29H23N7/c1-20(21-8-4-2-5-9-21)32-29-30-17-16-28(33-29)36-19-31-26-18-23(12-15-27(26)36)25-14-13-24(34-35-25)22-10-6-3-7-11-22/h2-20H,1H3,(H,30,32,33)