5-chloranyl-2-[3-chloranyl-2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3-benzothiazole

Systemtic Name: 5-chloranyl-2-[3-chloranyl-2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3-benzothiazole Openeye Name: 5-chloro-2-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3-benzothiazole CAS Name: 5-chloro-2-[[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]thio]-1,3-benzothiazole IUPAC Name: 5-chloro-2-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3-benzothiazole Traditional Name: 5-chloro-2-[[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]thio]-1,3-benzothiazole Formula: C14H4Cl2F3N3O4S2 MolecularWeight: 470.23047

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N=C(S2)SC3=C(C=C(C(=C3[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1Cl)N=C(S2)SC3=C(C=C(C(=C3[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H4Cl2F3N3O4S2/c15-5-1-2-9-7(3-5)20-13(27-9)28-12-8(21(23)24)4-6(14(17,18)19)10(16)11(12)22(25)26/h1-4H