2-[2-[3,5-bis(trifluoromethyl)phenyl]ethylsulfonyl]-1,3-benzothiazole

Systemtic Name: 2-[2-[3,5-bis(trifluoromethyl)phenyl]ethylsulfonyl]-1,3-benzothiazole Openeye Name: 2-[2-[3,5-bis(trifluoromethyl)phenyl]ethylsulfonyl]-1,3-benzothiazole CAS Name: 2-[2-[3,5-bis(trifluoromethyl)phenyl]ethylsulfonyl]-1,3-benzothiazole IUPAC Name: 2-[2-[3,5-bis(trifluoromethyl)phenyl]ethylsulfonyl]-1,3-benzothiazole Traditional Name: 2-[2-[3,5-bis(trifluoromethyl)phenyl]ethylsulfonyl]-1,3-benzothiazole Formula: C17H11F6NO2S2 MolecularWeight: 439.395159

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)CCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)S(=O)(=O)CCC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C17H11F6NO2S2/c18-16(19,20)11-7-10(8-12(9-11)17(21,22)23)5-6-28(25,26)15-24-13-3-1-2-4-14(13)27-15/h1-4,7-9H,5-6H2