Chemical Component Summary

NameN-[TOSYL-D-PROLINYL]AMINO-ETHANETHIOL
Identifiers(1S,2R)-1-(4-methylphenyl)sulfonyl-N-(2-sulfanylethyl)pyrrolidine-2-carboxamide
FormulaC14 H20 N2 O3 S2
Molecular Weight328.45
TypeNON-POLYMER
Isomeric SMILESCc1ccc(cc1)S(=O)(=O)[N@]2CCC[C@@H]2C(=O)NCCS
InChIInChI=1S/C14H20N2O3S2/c1-11-4-6-12(7-5-11)21(18,19)16-9-2-3-13(16)14(17)15-8-10-20/h4-7,13,20H,2-3,8-10H2,1H3,(H,15,17)/t13-/m1/s1
InChIKeyNWUYDTGYTUQMDG-CYBMUJFWSA-N

Chemical Details

Formal Charge0
Atom Count41
Chiral Atom Count1
Bond Count42
Aromatic Bond Count6

Drug Info: DrugBank

DrugBank IDDB03818 
NameN-[Tosyl-D-Prolinyl]Amino-Ethanethiol
Groups experimental
SynonymsN-[Tosyl-D-Prolinyl]Amino-Ethanethiol

Drug Targets

NameTarget SequencePharmacological ActionActions
Thymidylate synthaseMKQYLELMQKVLDEGTQKNDRTGTGTLSIFGHQMRFNLQDGFPLVTTKRC...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

Related Resource References

Resource NameReference
PubChem 445503