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

Systemtic Name: 1-[2-[[4-(3-bromanylthiophen-2-yl)pyrimidin-2-yl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)urea Openeye Name: 1-[2-[[4-(3-bromo-2-thienyl)pyrimidin-2-yl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)urea CAS Name: 1-[2-[[4-(3-bromo-2-thiophenyl)-2-pyrimidinyl]amino]phenyl]-3-(6-phenyl-3-pyridazinyl)urea IUPAC Name: 1-[2-[[4-(3-bromothiophen-2-yl)pyrimidin-2-yl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)urea Traditional Name: 1-[2-[[4-(3-bromo-2-thienyl)pyrimidin-2-yl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)urea Formula: C25H18BrN7OS MolecularWeight: 544.42572

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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=CC(=N4)C5=C(C=CS5)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C=C2)NC(=O)NC3=CC=CC=C3NC4=NC=CC(=N4)C5=C(C=CS5)Br

InChI

InChI=1S/C25H18BrN7OS/c26-17-13-15-35-23(17)21-12-14-27-24(29-21)28-19-8-4-5-9-20(19)30-25(34)31-22-11-10-18(32-33-22)16-6-2-1-3-7-16/h1-15H,(H,27,28,29)(H2,30,31,33,34)