Vitas-M small molecule compound

(5-methyl-6-nitro-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)acetic acid

Catalog ID
STK778613
SMILES OC(=O)Cc1nn2c(n1)[nH]c(c(c2=O)[N+](=O)[O-])C

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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 C8H7N5O5 MW 253.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H7N5O5/c1-3-6(13(17)18)7(16)12-8(9-3)10-4(11-12)2-5(14)15/h2H2,1H3,(H,14,15)(H,9,10,11)
InChIKey
ZBJRYOMMZULGFZ-UHFFFAOYSA-N
Synonyms
212248-06-1
(5methyl6nitro7oxo47dihydro(124)triazolo(15a)pyrimidin2yl)aceticacid
2(5METHYL6NITRO7OXO1H(124)TRIAZOLO(15A)PYRIMIDIN2YL)ACETICACID
2(5METHYL6NITRO7OXO47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN2YL)ACETICACID
2(5METHYL6NITRO7OXO48DIHYDRO124TRIAZOLO(15A)PYRIMIDIN2YL)ACETICACID
212248061
CC1=C(C(=O)N2C(=N1)N=C(N2)CC(=O)O)(N+)(=O)(O)
InChI=1SC8H7N5O5c136(13(17)18)7(16)128(93)104(1112)25(14)15h2H21H3(H1415)(H91011)
MFCD03299543
OC(=O)Cc1nn2c(n1)(nH)c(c(c2=O)(N+)(=O)(O))C
ZINC000100018514
ZINC100018514
ZINC9761105

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Available files

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