Vitas-M small molecule compound
(2E)-2-[(4-methoxyphenyl)imino]-5-nitro-6-(piperidin-1-yl)-2,3-dihydropyrimidin-4-amine
Catalog ID
STL049637
SMILES COc1ccc(cc1)/N=c\1/nc(N2CCCCC2)c(c([nH]1)N)[N+](=O)[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 C16H20N6O3 MW 344.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N6O3/c1-25-12-7-5-11(6-8-12)18-16-19-14(17)13(22(23)24)15(20-16)21-9-3-2-4-10-21/h5-8H,2-4,9-10H2,1H3,(H3,17,18,19,20)InChIKey
KELOZRLBOXDOMY-UHFFFAOYSA-NSynonyms
714285-01-5(2E)2((4methoxyphenyl)imino)5nitro6(piperidin1yl)23dihydropyrimidin4amine
(4AMINO5NITRO6PIPERIDYLPYRIMIDIN2YL)(4METHOXYPHENYL)AMINE
2N(4METHOXYPHENYL)5NITRO6PIPERIDIN1YLPYRIMIDINE24DIAMINE
714285015
COC1=CC=C(C=C1)NC2=NC(=C(C(=N2)N)(N+)(=O)(O))N3CCCCC3
COc1ccc(cc1)N=c1nc(N2CCCCC2)c(c((nH)1)N)(N+)(=O)(O)
InChI=1SC16H20N6O3c125127511(6812)18161914(17)13(22(23)24)15(2016)2193241021h58H24910H21H3(H317181920)
MFCD05726269
ZINC000009287670
ZINC09287670
ZINC9287670
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