Products 2549192-46-1

CAS 2549192-46-1 is the registry number for Brexpiprazole Impurity 31. Offered by: Chemat Brand. Available pack sizes: on request.

Brexpiprazole Impurity 31
Chemat Brand
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  • Variants: 1
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Structural formula: {0} (CAS {1})

8-(1-benzothiophen-4-yl)-8-aza-5-azoniaspiro[4.5]decane hydroxide (CAS 2549192-46-1) is a chemical compound with the molecular formula C16H22N2OS and a molecular weight of 290.4 g/mol. IUPAC name: 8-(1-benzothiophen-4-yl)-8-aza-5-azoniaspiro[4.5]decane hydroxide. InChIKey: ICHKRSFQNUTAPP-UHFFFAOYSA-M.

Identity
Molecular formulaC16H22N2OS
Molecular weight290.4 g/mol
IUPAC name8-(1-benzothiophen-4-yl)-8-aza-5-azoniaspiro[4.5]decane hydroxide
InChIKeyICHKRSFQNUTAPP-UHFFFAOYSA-M
SMILESC1CC[N+]2(C1)CCN(CC2)C3=C4C=CSC4=CC=C3.[OH-]

Computed by PubChem (NCBI)

Synonyms: 2549192-46-1free base, 8-Benzo[b]thien-4-yl-5,8-diazaspiro[4.5]decan-5-ium Hydroxide, 8-(benzo[b]thiophen-4-yl)-5,8-diazaspiro[4.5]decan-5-ium hydroxide
Isomers (same molecular formula)
19-thia-15,17-diazatricyclo[10.7.0.013,18]nonadeca-1(12),13(18),16-trien-14-one C16H22N2OS
2-(2-methoxyethyl)-5-[(2R,5S)-5-methylpiperidin-2-yl]-1,3-benzothiazole C16H22N2OS
4-[4-(1-benzothiophen-4-yl)piperazin-1-yl]butan-1-ol C16H22N2OS
5-[(2S,5S)-5-methyl-4-propan-2-yloxypiperidin-2-yl]-1,3-benzothiazole C16H22N2OS