4-[[(2R)-4-(dimethylamino)-1-phenylsulfanyl-butan-2-yl]amino]-3-(trifluoromethylsulfonyl)benzenesulfonamide

Systemtic Name: 4-[[(2R)-4-(dimethylamino)-1-phenylsulfanyl-butan-2-yl]amino]-3-(trifluoromethylsulfonyl)benzenesulfonamide Openeye Name: 4-[[(1R)-3-(dimethylamino)-1-(phenylsulfanylmethyl)propyl]amino]-3-(trifluoromethylsulfonyl)benzenesulfonamide CAS Name: 4-[[(2R)-4-(dimethylamino)-1-(phenylthio)butan-2-yl]amino]-3-(trifluoromethylsulfonyl)benzenesulfonamide IUPAC Name: 4-[[(2R)-4-(dimethylamino)-1-phenylsulfanylbutan-2-yl]amino]-3-(trifluoromethylsulfonyl)benzenesulfonamide Traditional Name: 4-[[(1R)-3-(dimethylamino)-1-[(phenylthio)methyl]propyl]amino]-3-triflyl-benzenesulfonamide Formula: C19H24F3N3O4S3 MolecularWeight: 511.60177

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC(CSC1=CC=CC=C1)NC2=C(C=C(C=C2)S(=O)(=O)N)S(=O)(=O)C(F)(F)F

Isomeric SMILES

CN(C)CC[C@H](CSC1=CC=CC=C1)NC2=C(C=C(C=C2)S(=O)(=O)N)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C19H24F3N3O4S3/c1-25(2)11-10-14(13-30-15-6-4-3-5-7-15)24-17-9-8-16(32(23,28)29)12-18(17)31(26,27)19(20,21)22/h3-9,12,14,24H,10-11,13H2,1-2H3,(H2,23,28,29)/t14-/m1/s1