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Substance Name: 1045U85
RN: 129314-29-0
InChIKey: GHACVBCUANDNID-VQIMIIECSA-N

Note

  • Four stereoisomers, RR, SS, RS & SR are all pharmacologically active.

Molecular Weight

  • 388.4856
 
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Names and Synonyms

Name of Substance

  • 1045U85

Synonym

  • (4'-1-Hydroxy-2-(((1,2,3,4-tetrahydro-1-oxo-2-naphthyl)methyl)amino)ethyl)methanesulfonanilide hydrochloride

Registry Numbers

CAS Registry Number

  • 129314-29-0

System Generated Number

  • 0129314290

Structure Descriptors

InChI

1S/C20H24N2O4S/c1-27(25,26)22-17-10-8-15(9-11-17)19(23)13-21-12-16-7-6-14-4-2-3-5-18(14)20(16)24/h2-5,8-11,16,19,21-23H,6-7,12-13H2,1H3/t16-,19-/m1/s1

InChIKey

GHACVBCUANDNID-VQIMIIECSA-N

Smiles

CS(=O)(=O)Nc1ccc(cc1)[C@@H](CNC[C@H]2CCc3ccccc3C2=O)O