Products 155863-02-8

CAS 155863-02-8 is the registry number for 1-(2-Isothiocyanatoethyl)-4-[2-(3,4-dihydro-2H-1-benzopyranyl-6-yl)-5-oxazolyl]pyridinium bromide. Offered by: Chemat. Available pack sizes: 250mg, 50mg, 5mg.

1-(2-Isothiocyanatoethyl)-4-[2-(3,4-dihydro-2H-1-benzopyranyl-6-yl)-5-oxazolyl]pyridinium bromide
Chemat
  • size: 250mg, 50mg, 5mg
  • Variants: 3
from 629.11
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Structural formula: {0} (CAS {1})

2-(3,4-dihydro-2H-chromen-6-yl)-5-[1-(2-isothiocyanatoethyl)pyridin-1-ium-4-yl]-1,3-oxazole bromide (CAS 155863-02-8) is a chemical compound with the molecular formula C20H18BrN3O2S and a molecular weight of 444.3 g/mol. IUPAC name: 2-(3,4-dihydro-2H-chromen-6-yl)-5-[1-(2-isothiocyanatoethyl)pyridin-1-ium-4-yl]-1,3-oxazole bromide. InChIKey: DKHIKMKBZZKQPN-UHFFFAOYSA-M.

Identity
Molecular formulaC20H18BrN3O2S
Molecular weight444.3 g/mol
IUPAC name2-(3,4-dihydro-2H-chromen-6-yl)-5-[1-(2-isothiocyanatoethyl)pyridin-1-ium-4-yl]-1,3-oxazole bromide
InChIKeyDKHIKMKBZZKQPN-UHFFFAOYSA-M
SMILESC1CC2=C(C=CC(=C2)C3=NC=C(O3)C4=CC=[N+](C=C4)CCN=C=S)OC1.[Br-]

Computed by PubChem (NCBI)

Synonyms: 4-(2-(Chroman-6-yl)oxazol-5-yl)-1-(2-isothiocyanatoethyl)pyridin-1-ium bromide, C20H18BrN3O2S, 1-(2-Isothiocyatoethyl)-4-[2-(3,4-dihydro-2H-1-benzopyranyl-6-yl)-5-oxazolyl, 2-chroman-6-yl-5-[1-(2-isothiocyanatoethyl)pyridin-1-ium-4-yl]oxazole;bromide