2-[3-chloranyl-5-[2-(2,2-dimethylpropylsulfamoyl)ethyl-propan-2-yl-carbamoyl]phenoxy]ethyl-pyridin-4-yl-carbamic acid

Systemtic Name: 2-[3-chloranyl-5-[2-(2,2-dimethylpropylsulfamoyl)ethyl-propan-2-yl-carbamoyl]phenoxy]ethyl-pyridin-4-yl-carbamic acid Openeye Name: 2-[3-chloro-5-[2-(2,2-dimethylpropylsulfamoyl)ethyl-isopropyl-carbamoyl]phenoxy]ethyl-(4-pyridyl)carbamic acid CAS Name: 2-[3-chloro-5-[[2-(2,2-dimethylpropylsulfamoyl)ethyl-propan-2-ylamino]-oxomethyl]phenoxy]ethyl-pyridin-4-ylcarbamic acid IUPAC Name: 2-[3-chloro-5-[2-(2,2-dimethylpropylsulfamoyl)ethyl-propan-2-ylcarbamoyl]phenoxy]ethyl-pyridin-4-ylcarbamic acid Traditional Name: 2-[3-chloro-5-[isopropyl-[2-(neopentylsulfamoyl)ethyl]carbamoyl]phenoxy]ethyl-(4-pyridyl)carbamic acid Formula: C25H35ClN4O6S MolecularWeight: 555.0866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCS(=O)(=O)NCC(C)(C)C)C(=O)C1=CC(=CC(=C1)Cl)OCCN(C2=CC=NC=C2)C(=O)O

Isomeric SMILES

CC(C)N(CCS(=O)(=O)NCC(C)(C)C)C(=O)C1=CC(=CC(=C1)Cl)OCCN(C2=CC=NC=C2)C(=O)O

InChI

InChI=1S/C25H35ClN4O6S/c1-18(2)29(11-13-37(34,35)28-17-25(3,4)5)23(31)19-14-20(26)16-22(15-19)36-12-10-30(24(32)33)21-6-8-27-9-7-21/h6-9,14-16,18,28H,10-13,17H2,1-5H3,(H,32,33)