N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)-3-(trifluoromethyl)benzamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)-3-(trifluoromethyl)benzamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-[2-(2-thienyl)ethyl]-3-(trifluoromethyl)benzamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)-3-(trifluoromethyl)benzamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(2-thiophen-2-ylethyl)-3-(trifluoromethyl)benzamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-N-[2-(2-thienyl)ethyl]-3-(trifluoromethyl)benzamide Formula: C22H17F3N2O3S3 MolecularWeight: 510.57219

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)N(CCC3=CC=CS3)C(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)N(CCC3=CC=CS3)C(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H17F3N2O3S3/c1-33(29,30)17-7-8-18-19(13-17)32-21(26-18)27(10-9-16-6-3-11-31-16)20(28)14-4-2-5-15(12-14)22(23,24)25/h2-8,11-13H,9-10H2,1H3