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Substance Name: Btm 1073
RN: 107784-01-0
InChIKey: ULKPDEMITLLZHJ-NXCGSPNESA-N

Molecular Formula

  • C25-H34-N3-O-S.Br

Molecular Weight

  • 504.534
 
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Names and Synonyms

Name of Substance

  • Btm 1073

Synonyms

  • 2,3-Dihydro-3-(4-methylpiperazinylbutyl bromide)-2-phenyl-1,5-benzothiazepin-4(5H)-one
  • Btm-1073

Systematic Name

  • Piperazinium, 1-butyl-1-methyl-4-((2,3,4,5-tetrahydro-4-oxo-2-phenyl-1,5-benzothiazepin-3-yl)methyl)-, bromide, cis-

Registry Numbers

CAS Registry Number

  • 107784-01-0

System Generated Number

  • 0107784010

Molecular Formulas

Molecular Formula

  • C25-H34-N3-O-S.Br

Molecular Formula Fragments

  • Br
  • C25-H34-N3-O-S
  • COMPONENT

Structure Descriptors

InChI

1S/C25H33N3OS.BrH/c1-3-4-16-28(2)17-14-27(15-18-28)19-21-24(20-10-6-5-7-11-20)30-23-13-9-8-12-22(23)26-25(21)29;/h5-13,21,24H,3-4,14-19H2,1-2H3;1H/t21-,24+;/m0./s1

InChIKey

ULKPDEMITLLZHJ-NXCGSPNESA-N

Smiles

[N+]1(CCN(CC1)C[C@H]1[C@H](Sc2c(NC1=O)cccc2)c1ccccc1)(C)CCCC.[BrH-]