N-[5-chloranyl-4-[3-(4-methylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]-2-ethyl-butanamide

Systemtic Name: N-[5-chloranyl-4-[3-(4-methylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]-2-ethyl-butanamide Openeye Name: N-[5-chloro-2-hydroxy-4-[3-(p-tolylsulfonyl)butanoylamino]phenyl]-2-ethyl-butanamide CAS Name: N-[5-chloro-2-hydroxy-4-[[3-(4-methylphenyl)sulfonyl-1-oxobutyl]amino]phenyl]-2-ethylbutanamide IUPAC Name: N-[5-chloro-2-hydroxy-4-[3-(4-methylphenyl)sulfonylbutanoylamino]phenyl]-2-ethylbutanamide Traditional Name: N-[5-chloro-2-hydroxy-4-(3-tosylbutanoylamino)phenyl]-2-ethyl-butyramide Formula: C23H29ClN2O5S MolecularWeight: 481.00476

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=C(C=C(C(=C1)Cl)NC(=O)CC(C)S(=O)(=O)C2=CC=C(C=C2)C)O

Isomeric SMILES

CCC(CC)C(=O)NC1=C(C=C(C(=C1)Cl)NC(=O)CC(C)S(=O)(=O)C2=CC=C(C=C2)C)O

InChI

InChI=1S/C23H29ClN2O5S/c1-5-16(6-2)23(29)26-20-12-18(24)19(13-21(20)27)25-22(28)11-15(4)32(30,31)17-9-7-14(3)8-10-17/h7-10,12-13,15-16,27H,5-6,11H2,1-4H3,(H,25,28)(H,26,29)