Vitas-M small molecule compound
2-[(E)-2-(7-ethyl-1H-indol-3-yl)ethenyl]-5-nitropyrimidine-4,6-diol
Catalog ID
STK613769
SMILES CCc1cccc2c1[nH]cc2/C=C/c1nc(O)c(c(n1)O)[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 C16H14N4O4 MW 326.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O4/c1-2-9-4-3-5-11-10(8-17-13(9)11)6-7-12-18-15(21)14(20(23)24)16(22)19-12/h3-8,17H,2H2,1H3,(H2,18,19,21,22)/b7-6+InChIKey
CGNOSFJHPJMEFT-VOTSOKGWSA-NSynonyms
842956-05-22((1E)2(7ETHYLINDOL3YL)VINYL)6HYDROXY5NITRO3HYDROPYRIMIDIN4ONE
2((E)2(7ETHYL1HINDOL3YL)ETHENYL)4HYDROXY5NITRO1HPYRIMIDIN6ONE
2((E)2(7ethyl1Hindol3yl)ethenyl)5nitropyrimidine46diol
2((E)2(7ETHYL1HINDOL3YL)VINYL)6HYDROXY5NITRO3HPYRIMIDIN4ONE
CCC1=CC=CC2=C1NC=C2C=CC3=NC(=C(C(=O)N3)(N+)(=O)(O))O
CCc1cccc2c1(nH)cc2C=Cc1nc(O)c(c(n1)O)(N+)(=O)(O)
InChI=1SC16H14N4O4c1294351110(81713(9)11)67121815(21)14(20(23)24)16(22)1912h3817H2H21H3(H218192122)b76+
MFCD08732612
ZINC9010317
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