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

Systemtic Name: 1-[2-[[4-(3-bromanylthiophen-2-yl)-6-methyl-pyrimidin-2-yl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea Openeye Name: 1-[2-[[4-(3-bromo-2-thienyl)-6-methyl-pyrimidin-2-yl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea CAS Name: 1-[2-[[4-(3-bromo-2-thiophenyl)-6-methyl-2-pyrimidinyl]amino]phenyl]-3-(6-phenyl-3-pyridazinyl)thiourea IUPAC Name: 1-[2-[[4-(3-bromothiophen-2-yl)-6-methylpyrimidin-2-yl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea Traditional Name: 1-[2-[[4-(3-bromo-2-thienyl)-6-methyl-pyrimidin-2-yl]amino]phenyl]-3-(6-phenylpyridazin-3-yl)thiourea Formula: C26H20BrN7S2 MolecularWeight: 574.5179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=C(C=CS2)Br)NC3=CC=CC=C3NC(=S)NC4=NN=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NC(=NC(=C1)C2=C(C=CS2)Br)NC3=CC=CC=C3NC(=S)NC4=NN=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H20BrN7S2/c1-16-15-22(24-18(27)13-14-36-24)30-25(28-16)29-20-9-5-6-10-21(20)31-26(35)32-23-12-11-19(33-34-23)17-7-3-2-4-8-17/h2-15H,1H3,(H,28,29,30)(H2,31,32,34,35)