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

Systemtic Name: N-[[2-[2-chloranyl-4,5-bis(fluoranyl)phenyl]-1,3-benzoxazol-5-yl]carbamothioyl]ethanamide Openeye Name: N-[[2-(2-chloro-4,5-difluoro-phenyl)-1,3-benzoxazol-5-yl]carbamothioyl]acetamide CAS Name: N-[[[2-(2-chloro-4,5-difluorophenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: N-[[2-(2-chloro-4,5-difluorophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]acetamide Traditional Name: N-[[2-(2-chloro-4,5-difluoro-phenyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]acetamide Formula: C16H10ClF2N3O2S MolecularWeight: 381.784306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=S)NC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3Cl)F)F

Isomeric SMILES

CC(=O)NC(=S)NC1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3Cl)F)F

InChI

InChI=1S/C16H10ClF2N3O2S/c1-7(23)20-16(25)21-8-2-3-14-13(4-8)22-15(24-14)9-5-11(18)12(19)6-10(9)17/h2-6H,1H3,(H2,20,21,23,25)