N-(2-diethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide

Systemtic Name: N-(2-diethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide Openeye Name: N-(2-diethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide CAS Name: N-(2-diethylaminoethyl)-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-3-(trifluoromethyl)benzamide IUPAC Name: N-(2-diethylaminoethyl)-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-3-(trifluoromethyl)benzamide Traditional Name: N-(2-diethylaminoethyl)-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-3-(trifluoromethyl)benzamide Formula: C22H24F3N3OS2 MolecularWeight: 467.57067

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)SC)C(=O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C22H24F3N3OS2/c1-4-27(5-2)11-12-28(20(29)15-7-6-8-16(13-15)22(23,24)25)21-26-18-10-9-17(30-3)14-19(18)31-21/h6-10,13-14H,4-5,11-12H2,1-3H3