[2-(5-methyl-2-propan-2-yl-cyclohexyl)oxy-2-oxidanylidene-ethyl] 3,5-bis(thiophen-2-ylsulfonylamino)benzoate

Systemtic Name: [2-(5-methyl-2-propan-2-yl-cyclohexyl)oxy-2-oxidanylidene-ethyl] 3,5-bis(thiophen-2-ylsulfonylamino)benzoate Openeye Name: [2-(2-isopropyl-5-methyl-cyclohexoxy)-2-oxo-ethyl] 3,5-bis(2-thienylsulfonylamino)benzoate CAS Name: 3,5-bis(thiophen-2-ylsulfonylamino)benzoic acid [2-(5-methyl-2-propan-2-ylcyclohexyl)oxy-2-oxoethyl] ester IUPAC Name: [2-(5-methyl-2-propan-2-ylcyclohexyl)oxy-2-oxoethyl] 3,5-bis(thiophen-2-ylsulfonylamino)benzoate Traditional Name: 3,5-bis(2-thienylsulfonylamino)benzoic acid [2-(2-isopropyl-5-methyl-cyclohexoxy)-2-keto-ethyl] ester Formula: C27H32N2O8S4 MolecularWeight: 640.81158

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)COC(=O)C2=CC(=CC(=C2)NS(=O)(=O)C3=CC=CS3)NS(=O)(=O)C4=CC=CS4)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)COC(=O)C2=CC(=CC(=C2)NS(=O)(=O)C3=CC=CS3)NS(=O)(=O)C4=CC=CS4)C(C)C

InChI

InChI=1S/C27H32N2O8S4/c1-17(2)22-9-8-18(3)12-23(22)37-24(30)16-36-27(31)19-13-20(28-40(32,33)25-6-4-10-38-25)15-21(14-19)29-41(34,35)26-7-5-11-39-26/h4-7,10-11,13-15,17-18,22-23,28-29H,8-9,12,16H2,1-3H3