N-[(3-methyl-1-benzothiophen-2-yl)methyl]-3,5-bis(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[(3-methyl-1-benzothiophen-2-yl)methyl]-3,5-bis(trifluoromethyl)benzenesulfonamide Openeye Name: N-[(3-methylbenzothiophen-2-yl)methyl]-3,5-bis(trifluoromethyl)benzenesulfonamide CAS Name: N-[(3-methyl-1-benzothiophen-2-yl)methyl]-3,5-bis(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[(3-methyl-1-benzothiophen-2-yl)methyl]-3,5-bis(trifluoromethyl)benzenesulfonamide Traditional Name: N-[(3-methylbenzothiophen-2-yl)methyl]-3,5-bis(trifluoromethyl)benzenesulfonamide Formula: C18H13F6NO2S2 MolecularWeight: 453.421739

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)CNS(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)CNS(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H13F6NO2S2/c1-10-14-4-2-3-5-15(14)28-16(10)9-25-29(26,27)13-7-11(17(19,20)21)6-12(8-13)18(22,23)24/h2-8,25H,9H2,1H3