N-[6-[bis(fluoranyl)methylsulfanyl]-1,3-benzothiazol-2-yl]-3,5-ditert-butyl-benzamide

Systemtic Name: N-[6-[bis(fluoranyl)methylsulfanyl]-1,3-benzothiazol-2-yl]-3,5-ditert-butyl-benzamide Openeye Name: 3,5-ditert-butyl-N-[6-(difluoromethylsulfanyl)-1,3-benzothiazol-2-yl]benzamide CAS Name: 3,5-ditert-butyl-N-[6-(difluoromethylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 3,5-ditert-butyl-N-[6-(difluoromethylsulfanyl)-1,3-benzothiazol-2-yl]benzamide Traditional Name: 3,5-ditert-butyl-N-[6-(difluoromethylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C23H26F2N2OS2 MolecularWeight: 448.592146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26F2N2OS2/c1-22(2,3)14-9-13(10-15(11-14)23(4,5)6)19(28)27-21-26-17-8-7-16(29-20(24)25)12-18(17)30-21/h7-12,20H,1-6H3,(H,26,27,28)