N-[[2-[2,3,4,5,6-pentakis(fluoranyl)phenyl]-1,3-benzoxazol-5-yl]carbamothioyl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[[2-[2,3,4,5,6-pentakis(fluoranyl)phenyl]-1,3-benzoxazol-5-yl]carbamothioyl]-2,2-diphenyl-ethanamide Openeye Name: N-[[2-(2,3,4,5,6-pentafluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-2,2-diphenyl-acetamide CAS Name: N-[[[2-(2,3,4,5,6-pentafluorophenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-2,2-diphenylacetamide IUPAC Name: N-[[2-(2,3,4,5,6-pentafluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-2,2-diphenylacetamide Traditional Name: N-[[2-(2,3,4,5,6-pentafluorophenyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]-2,2-diphenyl-acetamide Formula: C28H16F5N3O2S MolecularWeight: 553.502556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=N4)C5=C(C(=C(C(=C5F)F)F)F)F

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=N4)C5=C(C(=C(C(=C5F)F)F)F)F

InChI

InChI=1S/C28H16F5N3O2S/c29-21-20(22(30)24(32)25(33)23(21)31)27-35-17-13-16(11-12-18(17)38-27)34-28(39)36-26(37)19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,19H,(H2,34,36,37,39)