4-[4-[[7-bromanyl-5-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]phenyl]sulfanyl-N-methyl-pyridine-2-carboxamide

Systemtic Name: 4-[4-[[7-bromanyl-5-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]phenyl]sulfanyl-N-methyl-pyridine-2-carboxamide Openeye Name: 4-[4-[[7-bromo-5-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]phenyl]sulfanyl-N-methyl-pyridine-2-carboxamide CAS Name: 4-[[4-[[7-bromo-5-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]phenyl]thio]-N-methyl-2-pyridinecarboxamide IUPAC Name: 4-[4-[[7-bromo-5-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]phenyl]sulfanyl-N-methylpyridine-2-carboxamide Traditional Name: 4-[[4-[[7-bromo-5-(trifluoromethyl)-1,3-benzoxazol-2-yl]amino]phenyl]thio]-N-methyl-picolinamide Formula: C21H14BrF3N4O2S MolecularWeight: 523.32567

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NC=CC(=C1)SC2=CC=C(C=C2)NC3=NC4=C(O3)C(=CC(=C4)C(F)(F)F)Br

Isomeric SMILES

CNC(=O)C1=NC=CC(=C1)SC2=CC=C(C=C2)NC3=NC4=C(O3)C(=CC(=C4)C(F)(F)F)Br

InChI

InChI=1S/C21H14BrF3N4O2S/c1-26-19(30)17-10-14(6-7-27-17)32-13-4-2-12(3-5-13)28-20-29-16-9-11(21(23,24)25)8-15(22)18(16)31-20/h2-10H,1H3,(H,26,30)(H,28,29)