2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-nitro-4-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-nitro-4-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-nitro-4-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)thio]-N-[2-nitro-4-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-N-[2-nitro-4-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)thio]-N-[2-nitro-4-(trifluoromethyl)phenyl]acetamide Formula: C16H9F3N4O5S2 MolecularWeight: 458.39167

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NC(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NC(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H9F3N4O5S2/c17-16(18,19)8-1-3-10(12(5-8)23(27)28)20-14(24)7-29-15-21-11-4-2-9(22(25)26)6-13(11)30-15/h1-6H,7H2,(H,20,24)