N-(2-chloranyl-5-methyl-phenyl)-4-(hydroxymethyl)-4-methyl-2-[4-methylsulfonyl-2-(methylsulfonylamino)phenoxy]-5-oxidanyl-3-oxidanylidene-pentanamide

Systemtic Name: N-(2-chloranyl-5-methyl-phenyl)-4-(hydroxymethyl)-4-methyl-2-[4-methylsulfonyl-2-(methylsulfonylamino)phenoxy]-5-oxidanyl-3-oxidanylidene-pentanamide Openeye Name: N-(2-chloro-5-methyl-phenyl)-5-hydroxy-4-(hydroxymethyl)-2-[2-(methanesulfonamido)-4-methylsulfonyl-phenoxy]-4-methyl-3-oxo-pentanamide CAS Name: N-(2-chloro-5-methylphenyl)-5-hydroxy-4-(hydroxymethyl)-2-[2-(methanesulfonamido)-4-methylsulfonylphenoxy]-4-methyl-3-oxopentanamide IUPAC Name: N-(2-chloro-5-methylphenyl)-5-hydroxy-4-(hydroxymethyl)-2-[2-(methanesulfonamido)-4-methylsulfonylphenoxy]-4-methyl-3-oxopentanamide Traditional Name: N-(2-chloro-5-methyl-phenyl)-5-hydroxy-3-keto-2-[4-mesyl-2-(methanesulfonamido)phenoxy]-4-methyl-4-methylol-valeramide Formula: C22H27ClN2O9S2 MolecularWeight: 563.04078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C(C)(CO)CO)OC2=C(C=C(C=C2)S(=O)(=O)C)NS(=O)(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C(C)(CO)CO)OC2=C(C=C(C=C2)S(=O)(=O)C)NS(=O)(=O)C

InChI

InChI=1S/C22H27ClN2O9S2/c1-13-5-7-15(23)16(9-13)24-21(29)19(20(28)22(2,11-26)12-27)34-18-8-6-14(35(3,30)31)10-17(18)25-36(4,32)33/h5-10,19,25-27H,11-12H2,1-4H3,(H,24,29)