Vitas-M small molecule compound
(5Z)-1-(4-bromophenyl)-5-(3-ethoxy-4-hydroxy-5-nitrobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK170150
SMILES CCOc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)Br)cc(c1O)[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 C19H14BrN3O7 MW 476.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14BrN3O7/c1-2-30-15-9-10(8-14(16(15)24)23(28)29)7-13-17(25)21-19(27)22(18(13)26)12-5-3-11(20)4-6-12/h3-9,24H,2H2,1H3,(H,21,25,27)/b13-7-InChIKey
DNHYNRUPKKVADX-QPEQYQDCSA-NSynonyms
(5Z)1(4BROMOPHENYL)5((3ETHOXY4HYDROXY5NITROPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(4BROMOPHENYL)5(3ETHOXY4HYDROXY5NITROBENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
CCOC1=CC(=CC(=C1O)(N+)(=O)(O))C=C2C(=O)NC(=O)N(C2=O)C3=CC=C(C=C3)Br
CCOc1cc(C=C2C(=O)NC(=O)N(C2=O)c2ccc(cc2)Br)cc(c1O)(N+)(=O)(O)
InChI=1SC19H14BrN3O7c123015910(814(16(15)24)23(28)29)71317(25)2119(27)22(18(13)26)125311(20)4612h3924H2H21H3(H212527)b137
MFCD04307903
ZINC000002985004
ZINC2985004
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