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Substance Name: 1,3,8-Triazaspiro(4,5)decane-3-carboxamide, N,N-dimethyl-4-oxo-1-phenyl-8-(3-(2-thenoyl)propyl)-, fumarate
RN: 54776-68-0
InChIKey: RWMGXOUJXCGGSP-WLHGVMLRSA-N

Molecular Formula

  • C24-H30-N4-O3-S.C4-H4-O4

Molecular Weight

  • 570.6636
 
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Names and Synonyms

  • 1,3,8-Triazaspiro(4,5)decane-3-carboxamide, N,N-dimethyl-4-oxo-1-phenyl-8-(3-(2-thenoyl)propyl)-, fumarate

Registry Numbers

CAS Registry Number

  • 54776-68-0

System Generated Number

  • 0054776680

Molecular Formulas

Molecular Formula

  • C24-H30-N4-O3-S.C4-H4-O4

Molecular Formula Fragments

  • C24-H30-N4-O3-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C24H30N4O3S.C4H4O4/c1-25(2)23(31)27-18-28(19-8-4-3-5-9-19)24(22(27)30)12-15-26(16-13-24)14-6-10-20(29)21-11-7-17-32-21;5-3(6)1-2-4(7)8/h3-5,7-9,11,17H,6,10,12-16,18H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

RWMGXOUJXCGGSP-WLHGVMLRSA-N

Smiles

CN(C)C(=O)N1CN(C2(C1=O)CCN(CC2)CCCC(=O)c3cccs3)c4ccccc4.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 20mg/kg (20mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#11910,