N-[bis(chloranyl)-fluoranyl-methyl]sulfanyl-N-(dimethylsulfamoyl)aniline; 5-chloranyl-7-(4-methylpiperidin-1-yl)-6-[2,4,6-tris(fluoranyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidine

Systemtic Name: N-[bis(chloranyl)-fluoranyl-methyl]sulfanyl-N-(dimethylsulfamoyl)aniline; 5-chloranyl-7-(4-methylpiperidin-1-yl)-6-[2,4,6-tris(fluoranyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidine Openeye Name: 5-chloro-7-(4-methyl-1-piperidyl)-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine; N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)aniline CAS Name: 5-chloro-7-(4-methyl-1-piperidinyl)-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine; 1,1-dichloro-N-(dimethylsulfamoyl)-1-fluoro-N-phenylmethanesulfenamide IUPAC Name: 5-chloro-7-(4-methylpiperidin-1-yl)-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine; N-[dichloro(fluoro)methyl]sulfanyl-N-(dimethylsulfamoyl)aniline Traditional Name: 5-chloro-7-(4-methylpiperidino)-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine; [[dichloro(fluoro)methyl]thio]-(dimethylsulfamoyl)-phenyl-amine Formula: C26H26Cl3F4N7O2S2 MolecularWeight: 715.012953

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C(=NC3=NC=NN23)Cl)C4=C(C=C(C=C4F)F)F.CN(C)S(=O)(=O)N(C1=CC=CC=C1)SC(F)(Cl)Cl

Isomeric SMILES

CC1CCN(CC1)C2=C(C(=NC3=NC=NN23)Cl)C4=C(C=C(C=C4F)F)F.CN(C)S(=O)(=O)N(C1=CC=CC=C1)SC(F)(Cl)Cl

InChI

InChI=1S/C17H15ClF3N5.C9H11Cl2FN2O2S2/c1-9-2-4-25(5-3-9)16-14(13-11(20)6-10(19)7-12(13)21)15(18)24-17-22-8-23-26(16)17;1-13(2)18(15,16)14(17-9(10,11)12)8-6-4-3-5-7-8/h6-9H,2-5H2,1H3;3-7H,1-2H3