(5-methyl-2-propan-2-yl-cyclohexyl) 2-[[4-(2,2-dimethoxyethyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 2-[[4-(2,2-dimethoxyethyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 2-[[4-(2,2-dimethoxyethyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-(2,2-dimethoxyethyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazol-3-yl]thio]acetic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 2-[[4-(2,2-dimethoxyethyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-(2,2-dimethoxyethyl)-5-[3-(dimethylsulfamoyl)phenyl]-1,2,4-triazol-3-yl]thio]acetic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C26H40N4O6S2 MolecularWeight: 568.749

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)CSC2=NN=C(N2CC(OC)OC)C3=CC(=CC=C3)S(=O)(=O)N(C)C)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)CSC2=NN=C(N2CC(OC)OC)C3=CC(=CC=C3)S(=O)(=O)N(C)C)C(C)C

InChI

InChI=1S/C26H40N4O6S2/c1-17(2)21-12-11-18(3)13-22(21)36-23(31)16-37-26-28-27-25(30(26)15-24(34-6)35-7)19-9-8-10-20(14-19)38(32,33)29(4)5/h8-10,14,17-18,21-22,24H,11-13,15-16H2,1-7H3