Vitas-M small molecule compound
(5Z)-1-(3-chloro-4-methylphenyl)-5-[(5-nitrofuran-2-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK712510
SMILES O=C1NC(=O)N(C(=O)/C/1=C\c1ccc(o1)[N+](=O)[O-])c1ccc(c(c1)Cl)C
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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 C16H10ClN3O6 MW 375.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10ClN3O6/c1-8-2-3-9(6-12(8)17)19-15(22)11(14(21)18-16(19)23)7-10-4-5-13(26-10)20(24)25/h2-7H,1H3,(H,18,21,23)/b11-7-InChIKey
VLQIDLXDBAKGAX-XFFZJAGNSA-NSynonyms
799817-00-8(5Z)1(3CHLORO4METHYLPHENYL)5((5NITROFURAN2YL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(3chloro4methylphenyl)5((5nitrofuran2yl)methylidene)pyrimidine246(1H3H5H)trione
(Z)1(3chloro4methylphenyl)5((5nitrofuran2yl)methylene)pyrimidine246(1H3H5H)trione
799817008
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)(N+)(=O)(O))C(=O)NC2=O)Cl
InChI=1SC16H10ClN3O6c18239(612(8)17)1915(22)11(14(21)1816(19)23)7104513(2610)20(24)25h27H1H3(H182123)b117
MFCD03681122
O=C1NC(=O)N(C(=O)C1=Cc1ccc(o1)(N+)(=O)(O))c1ccc(c(c1)Cl)C
ZINC000005033292
ZINC5033292
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