5-bromanyl-N-[[2-[2-chloranyl-4,5-bis(fluoranyl)phenyl]-1,3-benzoxazol-5-yl]carbamothioyl]-2-methoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[2-[2-chloranyl-4,5-bis(fluoranyl)phenyl]-1,3-benzoxazol-5-yl]carbamothioyl]-2-methoxy-benzamide Openeye Name: 5-bromo-N-[[2-(2-chloro-4,5-difluoro-phenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-2-methoxy-benzamide CAS Name: 5-bromo-N-[[[2-(2-chloro-4,5-difluorophenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[[2-(2-chloro-4,5-difluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-2-methoxybenzamide Traditional Name: 5-bromo-N-[[2-(2-chloro-4,5-difluoro-phenyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]-2-methoxy-benzamide Formula: C22H13BrClF2N3O3S MolecularWeight: 552.775726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=C(C=C4Cl)F)F

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=C(C=C4Cl)F)F

InChI

InChI=1S/C22H13BrClF2N3O3S/c1-31-18-4-2-10(23)6-13(18)20(30)29-22(33)27-11-3-5-19-17(7-11)28-21(32-19)12-8-15(25)16(26)9-14(12)24/h2-9H,1H3,(H2,27,29,30,33)