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Substance Name: Sulbutiamine [INN]
RN: 3286-46-2
UNII: 42NCM1BW43
InChIKey: CKHJPWQVLKHBIH-GPAWKIAZSA-N

Note

  • A glutamatergic, dopaminergic, and neurotropic agent which in animals improved learning ability & resistance to fatigue.

Molecular Formula

  • C32-H46-N8-O6-S2

Molecular Weight

  • 702.897
 

Classification Code

  • Drug / Therapeutic Agent
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Names and Synonyms

Name of Substance

  • Sulbutiamine
  • Sulbutiamine [INN]
  • Thiamine disulfide O,O-diisobutyrate

Synonyms

  • 5-25-12-00169 (Beilstein Handbook Reference)
  • Arcalion
  • Bis(1-(2-isobutyryloxyethyl)-2-(N-((4-amino-2-methyl-5-pyrimidinyl)methyl)formamido)-1-propenyl)disulfid
  • Bis(1-(4-amino-2-methyl-5-pyrimidinyl)-2-formyl-3,9-dimethyl-8-oxo-2-aza-7-oxa-3-decen-4-yl)disulfid
  • Bisibuthiamine
  • Bisibutiamin
  • Bisibutiamine
  • BRN 0741531
  • EINECS 221-937-3
  • N,N'-(Dithiobis(2-(2-hydroxyethyl)-1-methylvinylene))bis(N-((4-amino-2-methyl-5-pyrimidinyl)methyl)formamide) diisobutyrate (ester)
  • O,O'-Diisobutyrylthiamine disulfide
  • O-Isobutyroylthiamine disulfide
  • Sulbutiamina
  • Sulbutiamina [INN-Spanish]
  • Sulbutiamine
  • Sulbutiaminum
  • Sulbutiaminum [INN-Latin]
  • UNII-42NCM1BW43
  • Vitaberin

Systematic Names

  • Formamide, N,N'-(dithiobis(2-(2-hydroxyethyl)-1-methylvinylene))bis(N-((4-amino-2-methyl-5-pyrimidinyl)methyl)-, diisobutyrate (ester)
  • N,N'-(Dithiobis(2-(2-hydroxyethyl)-1-methylvinylene))bis(N-((4-amino-2-methyl-5-pyrimidinyl)methyl)formamide) diisobutyrate (ester)
  • Propanoic acid, 2-methyl-, dithiobis(3-(1-(((4-amino-2-methyl-5-pyrimidinyl)methyl)formylamino)ethylidene)-3,1-propanediyl) ester
  • Sulbutiamine

Registry Numbers

CAS Registry Number

  • 3286-46-2

FDA UNII

  • 42NCM1BW43

System Generated Number

  • 0003286462

Structure Descriptors

InChI

1S/C32H46N8O6S2/c1-19(2)31(43)45-11-9-27(21(5)39(17-41)15-25-13-35-23(7)37-29(25)33)47-48-28(10-12-46-32(44)20(3)4)22(6)40(18-42)16-26-14-36-24(8)38-30(26)34/h13-14,17-20H,9-12,15-16H2,1-8H3,(H2,33,35,37)(H2,34,36,38)/b27-21+,28-22+

InChIKey

CKHJPWQVLKHBIH-GPAWKIAZSA-N

Smiles

Cc1ncc(CN(C=O)C(\C)=C(/SSC(\CCOC(C(C)C)=O)=C(\C)N(C=O)Cc2cnc(C)nc2N)CCOC(C(C)C)=O)c(N)n1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 2500mg/kg (2500mg/kg)   Drugs in Japan Vol. 6, Pg. 606, 1982.
mouse LD50 oral > 5gm/kg (5000mg/kg)   Drugs in Japan Vol. 6, Pg. 606, 1982.
mouse LD50 subcutaneous > 3gm/kg (3000mg/kg)   Drugs in Japan Vol. 6, Pg. 606, 1982.
rat LD50 intraperitoneal 660mg/kg (660mg/kg)   Drugs in Japan Vol. 6, Pg. 606, 1982.
rat LD50 intravenous 110mg/kg (110mg/kg)   Drugs in Japan Vol. 6, Pg. 606, 1982.
rat LD50 oral > 5gm/kg (5000mg/kg)   Drugs in Japan Vol. 6, Pg. 606, 1982.
rat LD50 subcutaneous 850mg/kg (850mg/kg)   Drugs in Japan Vol. 6, Pg. 606, 1982.