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

Systemtic Name: N-[6-[bis(fluoranyl)methylsulfanyl]-1,3-benzothiazol-2-yl]-4-nitro-benzamide Openeye Name: N-[6-(difluoromethylsulfanyl)-1,3-benzothiazol-2-yl]-4-nitro-benzamide CAS Name: N-[6-(difluoromethylthio)-1,3-benzothiazol-2-yl]-4-nitrobenzamide IUPAC Name: N-[6-(difluoromethylsulfanyl)-1,3-benzothiazol-2-yl]-4-nitrobenzamide Traditional Name: N-[6-(difluoromethylthio)-1,3-benzothiazol-2-yl]-4-nitro-benzamide Formula: C15H9F2N3O3S2 MolecularWeight: 381.377066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)SC(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)SC(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H9F2N3O3S2/c16-14(17)24-10-5-6-11-12(7-10)25-15(18-11)19-13(21)8-1-3-9(4-2-8)20(22)23/h1-7,14H,(H,18,19,21)