Chem
J-GLOBAL ID：200907060196989687   Nikkaji number：J18.811E

Etintidine

エチンチジン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C12H16N6S
Molecular formula furigana： C12-H16-N6-S
Molecular weight： 276.360
InChI： InChI=1S/C12H16N6S/c1-3-4-14-12(16-8-13)15-5-6-19-7-11-10(2)17-9-18-11/h1,9H,4-7H2,2H3,(H,17,18)(H2,14,15,16)
InChI key： KEDVUOWPLAHMLZ-UHFFFAOYSA-N
SMILES： Cc1[nH]cnc1CSCCNC(=NCC#C)NC#N
Systematic name  (4)：
  • N-シアノ-N′-[2-[[(5-メチル-1H-イミダゾール-4-イル)メチル]チオ]エチル]-N′′-(2-プロピニル)グアニジン
  • 2-シアノ-1-[2-[[(5-メチル-1H-イミダゾール-4-イル)メチル]チオ]エチル]-3-(2-プロピニル)グアニジン
  • N-シアノ-N'-(2-{[(5-メチル-1H-イミダゾール-4-イル)メチル]スルファニル}エチル)-N''-(プロパ-2-イン-1-イル)グアニジン
  • N-cyano-N'-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)-N''-(prop-2-yn-1-yl)guanidine
Other name (4)：
  • エチンチジン
  • Etintidine
  • N-Cyano-N′-[2-[[(5-methyl-1H-imidazol-4-yl)methyl]thio]ethyl]-N′′-(2-propynyl)guanidine
  • 2-Cyano-1-[2-[[(5-methyl-1H-imidazol-4-yl)methyl]thio]ethyl]-3-(2-propynyl)guanidine
CAS registry number： 69539-53-3
Regulation number (1)：
  • EINECS2740362
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