Vitas-M small molecule compound

methyl 5-methyl-6-nitro-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylate

Catalog ID
STK825244
SMILES COC(=O)c1nn2c(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/c1-3-4(13(16)17)6(14)12-8(9-3)10-5(11-12)7(15)18-2/h1-2H3,(H,9,10,11)
InChIKey
VXOOPAFDKUPVLR-UHFFFAOYSA-N
Synonyms
212248-03-8
212248038
CC1=C(C(=O)N2C(=N1)N=C(N2)C(=O)OC)(N+)(=O)(O)
COC(=O)c1nn2c(n1)(nH)c(c(c2=O)(N+)(=O)(O))C
InChI=1SC8H7N5O5c134(13(16)17)6(14)128(93)105(1112)7(15)182h12H3(H91011)
METHYL5METHYL6NITRO7OXO17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE2CARBOXYLATE
METHYL5METHYL6NITRO7OXO1H(124)TRIAZOLO(15A)PYRIMIDINE2CARBOXYLATE
methyl5methyl6nitro7oxo47dihydro(124)triazolo(15a)pyrimidine2carboxylate
METHYL7HYDROXY5METHYL6NITRO8HYDRO124TRIAZOLO(15A)PYRIMIDINE2CARBOXYLATE
MFCD03292206
ZINC000100847329
ZINC100847329
ZINC2339996

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Available files

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