4-acetamido-N-[6-[bis(fluoranyl)methylsulfanyl]-1,3-benzothiazol-2-yl]benzamide

Systemtic Name: 4-acetamido-N-[6-[bis(fluoranyl)methylsulfanyl]-1,3-benzothiazol-2-yl]benzamide Openeye Name: 4-acetamido-N-[6-(difluoromethylsulfanyl)-1,3-benzothiazol-2-yl]benzamide CAS Name: 4-acetamido-N-[6-(difluoromethylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 4-acetamido-N-[6-(difluoromethylsulfanyl)-1,3-benzothiazol-2-yl]benzamide Traditional Name: 4-acetamido-N-[6-(difluoromethylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C17H13F2N3O2S2 MolecularWeight: 393.430826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)SC(F)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)SC(F)F

InChI

InChI=1S/C17H13F2N3O2S2/c1-9(23)20-11-4-2-10(3-5-11)15(24)22-17-21-13-7-6-12(25-16(18)19)8-14(13)26-17/h2-8,16H,1H3,(H,20,23)(H,21,22,24)