N-[5-chloranyl-4-[2-(3-methylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[5-chloranyl-4-[2-(3-methylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]-2,2-dimethyl-propanamide Openeye Name: N-[5-chloro-2-hydroxy-4-[2-(m-tolylsulfonyl)butanoylamino]phenyl]-2,2-dimethyl-propanamide CAS Name: N-[5-chloro-2-hydroxy-4-[[2-(3-methylphenyl)sulfonyl-1-oxobutyl]amino]phenyl]-2,2-dimethylpropanamide IUPAC Name: N-[5-chloro-2-hydroxy-4-[2-(3-methylphenyl)sulfonylbutanoylamino]phenyl]-2,2-dimethylpropanamide Traditional Name: N-[5-chloro-2-hydroxy-4-[2-(m-tolylsulfonyl)butanoylamino]phenyl]-2,2-dimethyl-propionamide Formula: C22H27ClN2O5S MolecularWeight: 466.97818

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1Cl)NC(=O)C(C)(C)C)O)S(=O)(=O)C2=CC=CC(=C2)C

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1Cl)NC(=O)C(C)(C)C)O)S(=O)(=O)C2=CC=CC(=C2)C

InChI

InChI=1S/C22H27ClN2O5S/c1-6-19(31(29,30)14-9-7-8-13(2)10-14)20(27)24-16-12-18(26)17(11-15(16)23)25-21(28)22(3,4)5/h7-12,19,26H,6H2,1-5H3,(H,24,27)(H,25,28)