440

3-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}propane-1-thiol

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is present as a standalone ligand in 1 entries

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Chemical Component Summary
Name	3-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}propane-1-thiol
Identifiers	3-(4-but-2-ynoxyphenyl)sulfonylpropane-1-thiol
Formula	C₁₃ H₁₆ O₃ S₂
Molecular Weight	284.394
Type	NON-POLYMER
Isomeric SMILES	CC#CCOc1ccc(cc1)S(=O)(=O)CCCS
InChI	InChI=1S/C13H16O3S2/c1-2-3-9-16-12-5-7-13(8-6-12)18(14,15)11-4-10-17/h5-8,17H,4,9-11H2,1H3
InChIKey	CARKQNSZFCLNKM-UHFFFAOYSA-N

Chemical Details
Formal Charge	0
Atom Count	34
Chiral Atom Count	0
Bond Count	34
Aromatic Bond Count	6

Drug Info: DrugBank

DrugBank ID	DB07079
Name	3-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}propane-1-thiol
Groups	experimental
Synonyms	3-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}propane-1-thiol

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Disintegrin and metalloproteinase domain-containing protein 17	MRQSLLFLTSVVPFVLAPRPPDDPGFGPHQRLEKLDSLLSDYDILSLSNI...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682