Tialamide

Molecule SVG Image

Properties Simple | Detailed

Formula C15H18ClN3O3S
IUPAC Name 5-chloro-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxo-ethyl]-1,3-benzothiazol-2-one
Molecular Mass 355.840 g·mol−1
Heat of Formation -416.3 ± 16.7 kJ·mol−1
Dipole Moment 3.25 ± 1.08 D
Volume 390.98 Å 3
Surface Area 319.49 Å 2
HOMO Energy -9.02 ± 0.55 eV
LUMO Energy -0.99 ± eV
Point Group Symmetry C1
Synonyms
  • 1-piperazineethanol, 4-((5-chloro-2-oxo-3(2h)-benzothiazolyl)acetyl)- (9ci)
  • 1-piperazineethanol, 4-((5-chloro-2-oxo-3-benzothiazolinyl)acetyl)-
  • 1-piperazineethanol, 4-[(5-chloro-2-oxo-3(2h)-benzothiazolyl)acetyl]-
  • 32527-55-2 (free base)
  • 35941-71-0 (hydrochloride salt)
  • 4-((5-chloro-2-oxo-3(2h)-benzothiazolyl)acetyl)-1-piperazineethanol
  • 5-chlor-2,3-dihydro-3-(4-(2-hydroxyethyl)piperazinylcarbonylmethyl)-2-benzothiazolon
  • 5-chloro-3-[2-[4-(2-hydroxyethyl)-1-piperazinyl]-2-oxoethyl]-1,3-benzothiazol-2-one
  • 5-chloro-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-keto-ethyl]-1,3-benzothiazol-2-one
  • 5-chloro-3-{2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl}-1,3-benzothiazol-2(3h)-one
  • oprea1_708738
  • rhc 2592a
  • tiaramide
  • usv 2592
InChIKey HTJXMOGUGMSZOG-UHFFFAOYSA-N
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Elements C Cl H O N S