Vitas-M small molecule compound
2-[(Z)-2-(2-ethoxy-3-methoxyphenyl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Catalog ID
STL358758
SMILES CCOc1c(cccc1OC)/C=C\c1nc(O)c(c(=O)[nH]1)[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 C15H15N3O6 MW 333.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15N3O6/c1-3-24-13-9(5-4-6-10(13)23-2)7-8-11-16-14(19)12(18(21)22)15(20)17-11/h4-8H,3H2,1-2H3,(H2,16,17,19,20)/b8-7-InChIKey
HAMRVPODIZAIQD-FPLPWBNLSA-NSynonyms
2((1Z)2(2ETHOXY3METHOXYPHENYL)VINYL)6HYDROXY5NITRO3HYDROPYRIMIDIN4ONE
2((Z)2(2ETHOXY3METHOXYPHENYL)ETHENYL)4HYDROXY5NITRO1HPYRIMIDIN6ONE
2((Z)2(2ethoxy3methoxyphenyl)ethenyl)6hydroxy5nitropyrimidin4(3H)one
CCOC1=C(C=CC=C1OC)C=CC2=NC(=C(C(=O)N2)(N+)(=O)(O))O
CCOc1c(cccc1OC)C=Cc1nc(O)c(c(=O)(nH)1)(N+)(=O)(O)
InChI=1SC15H15N3O6c1324139(54610(13)232)78111614(19)12(18(21)22)15(20)1711h48H3H212H3(H216171920)b87
MFCD06010598
ZINC000013482079
ZINC13482079
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