Vitas-M small molecule compound
(5Z)-1-(2,4-dichlorophenyl)-5-(4-hydroxy-3-nitrobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK175173
SMILES Clc1ccc(c(c1)Cl)N1C(=O)NC(=O)/C(=C/c2ccc(c(c2)[N+](=O)[O-])O)/C1=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 C17H9Cl2N3O6 MW 422.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H9Cl2N3O6/c18-9-2-3-12(11(19)7-9)21-16(25)10(15(24)20-17(21)26)5-8-1-4-14(23)13(6-8)22(27)28/h1-7,23H,(H,20,24,26)/b10-5-InChIKey
KIQHFPAWMHIIRM-YHYXMXQVSA-NSynonyms
(5Z)1(24DICHLOROPHENYL)5((4HYDROXY3NITROPHENYL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(24DICHLOROPHENYL)5(4HYDROXY3NITROBENZYLIDENE)PYRIMIDINE246(1H3H5H)TRIONE
C1=CC(=C(C=C1C=C2C(=O)NC(=O)N(C2=O)C3=C(C=C(C=C3)Cl)Cl)(N+)(=O)(O))O
Clc1ccc(c(c1)Cl)N1C(=O)NC(=O)C(=Cc2ccc(c(c2)(N+)(=O)(O))O)C1=O
InChI=1SC17H9Cl2N3O6c1892312(11(19)79)2116(25)10(15(24)2017(21)26)581414(23)13(68)22(27)28h1723H(H202426)b105
MFCD03729740
ZINC000002993236
ZINC2993236
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