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

Systemtic Name: N-[5-chloranyl-4-[2-(3-methylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]-2-phenoxy-butanamide Openeye Name: N-[5-chloro-2-hydroxy-4-[2-(m-tolylsulfonyl)butanoylamino]phenyl]-2-phenoxy-butanamide CAS Name: N-[5-chloro-2-hydroxy-4-[[2-(3-methylphenyl)sulfonyl-1-oxobutyl]amino]phenyl]-2-phenoxybutanamide IUPAC Name: N-[5-chloro-2-hydroxy-4-[2-(3-methylphenyl)sulfonylbutanoylamino]phenyl]-2-phenoxybutanamide Traditional Name: N-[5-chloro-2-hydroxy-4-[2-(m-tolylsulfonyl)butanoylamino]phenyl]-2-phenoxy-butyramide Formula: C27H29ClN2O6S MolecularWeight: 545.04696

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C(=C1)Cl)NC(=O)C(CC)S(=O)(=O)C2=CC=CC(=C2)C)O)OC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C(=C1)Cl)NC(=O)C(CC)S(=O)(=O)C2=CC=CC(=C2)C)O)OC3=CC=CC=C3

InChI

InChI=1S/C27H29ClN2O6S/c1-4-24(36-18-11-7-6-8-12-18)26(32)30-22-15-20(28)21(16-23(22)31)29-27(33)25(5-2)37(34,35)19-13-9-10-17(3)14-19/h6-16,24-25,31H,4-5H2,1-3H3,(H,29,33)(H,30,32)