3-(2-methyl-3-oxidanyl-propyl)-5-(4-methylsulfonylphenoxy)-N-(1,3-thiazol-2-yl)benzamide

Systemtic Name: 3-(2-methyl-3-oxidanyl-propyl)-5-(4-methylsulfonylphenoxy)-N-(1,3-thiazol-2-yl)benzamide Openeye Name: 3-(3-hydroxy-2-methyl-propyl)-5-(4-methylsulfonylphenoxy)-N-thiazol-2-yl-benzamide CAS Name: 3-(3-hydroxy-2-methylpropyl)-5-(4-methylsulfonylphenoxy)-N-(2-thiazolyl)benzamide IUPAC Name: 3-(3-hydroxy-2-methylpropyl)-5-(4-methylsulfonylphenoxy)-N-(1,3-thiazol-2-yl)benzamide Traditional Name: 3-(3-hydroxy-2-methyl-propyl)-5-(4-mesylphenoxy)-N-thiazol-2-yl-benzamide Formula: C21H22N2O5S2 MolecularWeight: 446.53978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC(=C1)C(=O)NC2=NC=CS2)OC3=CC=C(C=C3)S(=O)(=O)C)CO

Isomeric SMILES

CC(CC1=CC(=CC(=C1)C(=O)NC2=NC=CS2)OC3=CC=C(C=C3)S(=O)(=O)C)CO

InChI

InChI=1S/C21H22N2O5S2/c1-14(13-24)9-15-10-16(20(25)23-21-22-7-8-29-21)12-18(11-15)28-17-3-5-19(6-4-17)30(2,26)27/h3-8,10-12,14,24H,9,13H2,1-2H3,(H,22,23,25)