N-(5-chloranylpyridin-2-yl)-3-[[4-(pyrimidin-2-ylamino)cyclohexyl]carbonylamino]-1-benzofuran-2-carboxamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-3-[[4-(pyrimidin-2-ylamino)cyclohexyl]carbonylamino]-1-benzofuran-2-carboxamide Openeye Name: N-(5-chloro-2-pyridyl)-3-[[4-(pyrimidin-2-ylamino)cyclohexanecarbonyl]amino]benzofuran-2-carboxamide CAS Name: N-(5-chloro-2-pyridinyl)-3-[[oxo-[4-(2-pyrimidinylamino)cyclohexyl]methyl]amino]-2-benzofurancarboxamide IUPAC Name: N-(5-chloropyridin-2-yl)-3-[[4-(pyrimidin-2-ylamino)cyclohexanecarbonyl]amino]-1-benzofuran-2-carboxamide Traditional Name: N-(5-chloro-2-pyridyl)-3-[[4-(2-pyrimidylamino)cyclohexanecarbonyl]amino]coumarilamide Formula: C25H23ClN6O3 MolecularWeight: 490.94152

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)NC2=C(OC3=CC=CC=C32)C(=O)NC4=NC=C(C=C4)Cl)NC5=NC=CC=N5

Isomeric SMILES

C1CC(CCC1C(=O)NC2=C(OC3=CC=CC=C32)C(=O)NC4=NC=C(C=C4)Cl)NC5=NC=CC=N5

InChI

InChI=1S/C25H23ClN6O3/c26-16-8-11-20(29-14-16)31-24(34)22-21(18-4-1-2-5-19(18)35-22)32-23(33)15-6-9-17(10-7-15)30-25-27-12-3-13-28-25/h1-5,8,11-15,17H,6-7,9-10H2,(H,32,33)(H,27,28,30)(H,29,31,34)