4-(dimethylsulfamoyl)-N-[[5-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 4-(dimethylsulfamoyl)-N-[[5-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 4-(dimethylsulfamoyl)-N-[[5-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 4-(dimethylsulfamoyl)-N-[[5-[[2-(4-fluoroanilino)-2-oxoethyl]thio]-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-(dimethylsulfamoyl)-N-[[5-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 4-(dimethylsulfamoyl)-N-[[5-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]methyl]benzamide Formula: C27H27FN6O5S2 MolecularWeight: 598.668883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3OC)SCC(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=CC=CC=C3OC)SCC(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C27H27FN6O5S2/c1-33(2)41(37,38)21-14-8-18(9-15-21)26(36)29-16-24-31-32-27(34(24)22-6-4-5-7-23(22)39-3)40-17-25(35)30-20-12-10-19(28)11-13-20/h4-15H,16-17H2,1-3H3,(H,29,36)(H,30,35)