Vitas-M small molecule compound

2-(furan-2-yl)-3-methyl-6,7-dihydro-5H-cyclopenta[b]pyrazine 1,4-dioxide

Catalog ID
STK845534
SMILES [O-][n+]1c(c2ccco2)c(C)[n+](c2c1CCC2)[O-]

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C12H12N2O3 MW 232.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O3/c1-8-12(11-6-3-7-17-11)14(16)10-5-2-4-9(10)13(8)15/h3,6-7H,2,4-5H2,1H3
InChIKey
WQKLWHLSUSQKSK-UHFFFAOYSA-N
Synonyms
88819-92-5
(O)(n+)1c(c2ccco2)c(C)(n+)(c2c1CCC2)(O)
2(furan2yl)3methyl67dihydro5Hcyclopenta(b)pyrazine14dioxide
2FURAN2YL3METHYL67DIHYDRO5HCYCLOPENTAPYRAZINE14DIOXIDE
3(2FURYL)2METHYL567TRIHYDROCYCLOPENTA(12B)PYRAZINE14DIOL
3(FURAN2YL)2METHYL1OXIDO67DIHYDRO5HCYCLOPENTA(B)PYRAZIN4IUM4OXIDE
88819925
CC1=C((N+)(=O)C2=C(N1(O))CCC2)C3=CC=CO3
InChI=1SC12H12N2O3c1812(116371711)14(16)105249(10)13(8)15h367H245H21H3
MFCD03448314
ZINC000103943664
ZINC02383921
ZINC2383921

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Available files

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