N-oxidanyl-N-[5-phenyl-1-[4-(2-phenylethynyl)piperazin-1-yl]sulfonyl-hexan-2-yl]methanamide

Systemtic Name: N-oxidanyl-N-[5-phenyl-1-[4-(2-phenylethynyl)piperazin-1-yl]sulfonyl-hexan-2-yl]methanamide Openeye Name: N-hydroxy-N-[4-phenyl-1-[[4-(2-phenylethynyl)piperazin-1-yl]sulfonylmethyl]pentyl]formamide CAS Name: N-hydroxy-N-[5-phenyl-1-[[4-(2-phenylethynyl)-1-piperazinyl]sulfonyl]hexan-2-yl]formamide IUPAC Name: N-hydroxy-N-[5-phenyl-1-[4-(2-phenylethynyl)piperazin-1-yl]sulfonylhexan-2-yl]formamide Traditional Name: N-hydroxy-N-[4-phenyl-1-[[4-(2-phenylethynyl)piperazino]sulfonylmethyl]pentyl]formamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(CS(=O)(=O)N1CCN(CC1)C#CC2=CC=CC=C2)N(C=O)O)C3=CC=CC=C3

Isomeric SMILES

CC(CCC(CS(=O)(=O)N1CCN(CC1)C#CC2=CC=CC=C2)N(C=O)O)C3=CC=CC=C3

InChI

InChI=1S/C25H31N3O4S/c1-22(24-10-6-3-7-11-24)12-13-25(28(30)21-29)20-33(31,32)27-18-16-26(17-19-27)15-14-23-8-4-2-5-9-23/h2-11,21-22,25,30H,12-13,16-20H2,1H3