3-chloranyl-4-cyano-N-[4-[2-(3-methylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]benzamide

Systemtic Name: 3-chloranyl-4-cyano-N-[4-[2-(3-methylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]benzamide Openeye Name: 3-chloro-4-cyano-N-[2-hydroxy-4-[2-(m-tolylsulfonyl)butanoylamino]phenyl]benzamide CAS Name: 3-chloro-4-cyano-N-[2-hydroxy-4-[[2-(3-methylphenyl)sulfonyl-1-oxobutyl]amino]phenyl]benzamide IUPAC Name: 3-chloro-4-cyano-N-[2-hydroxy-4-[2-(3-methylphenyl)sulfonylbutanoylamino]phenyl]benzamide Traditional Name: 3-chloro-4-cyano-N-[2-hydroxy-4-[2-(m-tolylsulfonyl)butanoylamino]phenyl]benzamide Formula: C25H22ClN3O5S MolecularWeight: 511.97728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22ClN3O5S/c1-3-23(35(33,34)19-6-4-5-15(2)11-19)25(32)28-18-9-10-21(22(30)13-18)29-24(31)16-7-8-17(14-27)20(26)12-16/h4-13,23,30H,3H2,1-2H3,(H,28,32)(H,29,31)