Cimetidine

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Properties Simple | Detailed

Formula C10H16N6S
IUPAC Name 1-cyano-2-methyl-3-[2-[(5-methyl-1h-imidazol-4-yl)methylsulfanyl]ethyl]guanidine
Molecular Mass 252.339 g·mol−1
Heat of Formation 310.2 ± 16.7 kJ·mol−1
Dipole Moment 2.71 ± 1.08 D
Volume 314.51 Å 3
Surface Area 290.59 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy 3.15 ± eV
Point Group Symmetry C1
Synonyms
  • 1-cyano-2-methyl-3-(2-(((5-methyl-4-imidazolyl)methyl)thio)ethyl)guanidine
  • 1-cyano-2-methyl-3-[2-[[(5-methylimidazol-4-yl)methyl]thio]ethyl]guanidine
  • 2-cyano-1-methyl-3-(2-(((5-methylimidazol-4-yl)methyl)thio)ethyl)guanidine
  • 2-cyano-1-methyl-3-(2-{[(5-methyl-1h-imidazol-4-yl)methyl]sulfanyl}ethyl)guanidine
  • 2-cyano-1-methyl-3-(2-{[(5-methyl-1h-imidazol-4-yl)methyl]thio}ethyl)guanidine
  • 3-cyano-2-methyl-1-[2-[(5-methyl-1h-imidazol-4-yl)methylsulfanyl]ethyl]guanidine
  • 3-cyano-2-methyl-1-[2-[(5-methyl-1h-imidazol-4-yl)methylthio]ethyl]guanidine
  • acinil
  • bpbio1_000101
  • brumetidina
  • cimetag
  • cimetum
  • d00295
  • drg-0150
  • dyspamet
  • gastromet
  • guanidine, n''-cyano-n-methyl-n'-[2-[[(5-methyl-1h-imidazol-4-yl)methyl]thio]ethyl]-
  • guanidine, n-cyano-n'-methyl-n''-[2-[[(5-methyl-1h-imidazol-4-yl)methyl]thio]ethyl]-
  • n''-cyano-n-methyl-n'-[2-[(5-methyl-1h-imidazol-4-yl)methylthio]ethyl]guanidine
  • n-cyano-n'-methyl-n''-(2-(((5-methyl-1h-imidazol-4-yl)methyl)thio)ethyl)guanidine
  • skf 92334
  • skf-92334
  • tocris-0902
  • ulcedine
  • ulcimet
  • ulcomedina
  • ulcomet
CAS Number(s)
  • 51481-61-9
InChIKey AQIXAKUUQRKLND-UHFFFAOYSA-N
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