1-[2-fluoranyl-5-(trifluoromethyl)phenyl]-3-[5-(4-morpholin-4-ylcarbonyl-1H-pyrazolo[3,4-b]pyridin-6-yl)-1,3-thiazol-2-yl]urea

Systemtic Name: 1-[2-fluoranyl-5-(trifluoromethyl)phenyl]-3-[5-(4-morpholin-4-ylcarbonyl-1H-pyrazolo[3,4-b]pyridin-6-yl)-1,3-thiazol-2-yl]urea Openeye Name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-[5-[4-(morpholine-4-carbonyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]thiazol-2-yl]urea CAS Name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-[5-[4-[4-morpholinyl(oxo)methyl]-1H-pyrazolo[3,4-b]pyridin-6-yl]-2-thiazolyl]urea IUPAC Name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-[5-[4-(morpholine-4-carbonyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]-1,3-thiazol-2-yl]urea Traditional Name: 1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-[5-[4-(morpholine-4-carbonyl)-1H-pyrazolo[3,4-b]pyridin-6-yl]thiazol-2-yl]urea Formula: C22H17F4N7O3S MolecularWeight: 535.474093

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C2=CC(=NC3=C2C=NN3)C4=CN=C(S4)NC(=O)NC5=C(C=CC(=C5)C(F)(F)F)F

Isomeric SMILES

C1COCCN1C(=O)C2=CC(=NC3=C2C=NN3)C4=CN=C(S4)NC(=O)NC5=C(C=CC(=C5)C(F)(F)F)F

InChI

InChI=1S/C22H17F4N7O3S/c23-14-2-1-11(22(24,25)26)7-15(14)30-20(35)31-21-27-10-17(37-21)16-8-12(13-9-28-32-18(13)29-16)19(34)33-3-5-36-6-4-33/h1-2,7-10H,3-6H2,(H,28,29,32)(H2,27,30,31,35)