N-(3-nitrophenyl)-2-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(3-nitrophenyl)-2-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(3-nitrophenyl)-2-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]sulfanyl]acetamide CAS Name: N-(3-nitrophenyl)-2-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]thio]acetamide IUPAC Name: N-(3-nitrophenyl)-2-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]sulfanyl]acetamide Traditional Name: N-(3-nitrophenyl)-2-[[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]thio]acetamide Formula: C16H10F3N3O3S2 MolecularWeight: 413.39411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NC3=C(S2)C=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=NC3=C(S2)C=CC(=C3)C(F)(F)F

InChI

InChI=1S/C16H10F3N3O3S2/c17-16(18,19)9-4-5-13-12(6-9)21-15(27-13)26-8-14(23)20-10-2-1-3-11(7-10)22(24)25/h1-7H,8H2,(H,20,23)