Chemical Compound

Cetotiamine

CAS Registry Number 137-76-8
Cetotiamine chemical structure
Primary Record

Cetotiamine

In stock
1,573 g
Purity
99.6 %
CAS
137-76-8

Compound Identifiers & Properties

CAS
137-76-8
PubChem CID
3033983
SMILES
CCOC(=O)OCC/C(=C(\C)/N(CC1=CN=C(N=C1N)C)C=O)/SC(=O)OCC
Canonical SMILES
CCOC(=O)OCC/C(SC(=O)OCC)=C(\C)N(C=O)Cc1cnc(C)nc1N

Names & Synonyms

  • Cetotiamine
  • Cetotiamina
  • Cetotiaminum
  • Dicethiamin
  • Dicetamin
  • Cetotiamine [INN]
  • Dicethiamine
  • Cetotiamine HCl
  • DCET
  • Dicetamin (TN)
  • Cetotiaminum [INN-Latin]
  • O,S-Dicarbethoxythiamine
  • Cetotiamina [INN-Spanish]
  • CETOTIAMINE [MI]
  • AC1MHWOS
  • UNII-67IKV111BO
  • cetotiamine hydrochloride
  • RefChem:124703
  • 67IKV111BO
  • CETOTIAMINE [WHO-DD]
  • Cetotiaminum (INN-Latin)
  • Cetotiamina (INN-Spanish)
  • (Z)-11-hexadecenoic acid
  • O,S-Ethoxycarbonyl thiamine
  • YBROOZNJUDHTGE-QINSGFPZSA-N
  • O,S-Bis(ethoxycarbonyl)thiamine
  • SCHEMBL514876
  • 137-76-8
  • CHEMBL2105985
  • SCHEMBL29910241
  • C18H26N4O6S
  • CHEBI:135691
  • ZINC3872006
  • C18-H26-N4-O6-S
  • CID3033983
  • J5.640E
  • NCGC00183026-01
  • ethyl [(Z)-2-[(4-amino-2-methylpyrimidin-5-yl)methyl-formylamino]-5-ethoxycarbonyloxypent-2-en-3-yl]sulfanylformate
  • Q27264140
  • N-(5-(Ethoxycarbonyloxy)-3-(ethoxycarbonylthio)-2-penten-2-yl)-N-((4-amino-2-methyl-5-pyrimidinyl)methyl)formamid
  • S-Ester of O-ethyl thiocarbonate with N-((4-amino-2-methyl-5-pyrimidinyl)methyl)-N-(4-hydroxy-2-mercapto-1-methyl-1-butenyl)formamide ethyl carbonate
  • N-(5-(ETHOXYCARBONYLOXY)-3-(ETHOXYCARBONYLTHIO)-2-PENTEN-2-YL)-N-((4-AMINO-2-METHYL-5-PYRIMIDINYL)METHYL)FORMAMIDE
  • S-Ester of O-ethyl thiocarbonate with N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-(4-hydroxy-2-mercapto-1-methyl-1-butenyl)formamide ethyl carbonate
  • (3Z)-4-[[(4-Amino-2-methyl-5-pyrimidinyl)methyl](formyl)amino]-3-[(ethoxycarbonyl)sulfanyl]-3-pentenyl ethyl carbonate #
  • 4-Amino-5-[(4-ethoxycarbonyloxy-2-ethoxycarbonylthio-1-methyl-1-butenyl)-N-formylaminomethyl]-2-methylpyrimidine
  • Carbonic acid 4-[[(4-amino-2-methyl-5-pyrimidinyl)methyl](formyl)amino]-3-[(ethoxycarbonyl)thio]-3-pentenyl ethyl
  • Carbonic acid 4-[[(4-amino-2-methyl-5-pyrimidinyl)methyl](formyl)amino]-3-[(ethoxycarbonyl)thio]-3-pentenylethyl ester
  • Carbonic acid ethyl 4-[N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-formylamino]-3-(ethoxycarbonylthio)-3-pentenyl ester
  • ethyl [(2-{N-[(4-amino-2-methylpyrimidin-5-yl)methyl]formamido}-5-[(ethoxycarbonyl)oxy]pent-2-en-3-yl)sulfanyl]formate