Vitas-M small molecule compound
(5Z)-1-(3-chloro-4-methoxyphenyl)-5-[(5-nitrofuran-2-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK712516
SMILES COc1ccc(cc1Cl)N1C(=O)NC(=O)/C(=C/c2ccc(o2)[N+](=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 C16H10ClN3O7 MW 391.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H10ClN3O7/c1-26-12-4-2-8(6-11(12)17)19-15(22)10(14(21)18-16(19)23)7-9-3-5-13(27-9)20(24)25/h2-7H,1H3,(H,18,21,23)/b10-7-InChIKey
VZWAGMJKBSZTHJ-YFHOEESVSA-NSynonyms
799777-98-3(5Z)1(3CHLORO4METHOXYPHENYL)5((5NITROFURAN2YL)METHYLIDENE)13DIAZINANE246TRIONE
(5Z)1(3chloro4methoxyphenyl)5((5nitrofuran2yl)methylidene)pyrimidine246(1H3H5H)trione
(Z)1(3chloro4methoxyphenyl)5((5nitrofuran2yl)methylene)pyrimidine246(1H3H5H)trione
799777983
COC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)(N+)(=O)(O))C(=O)NC2=O)Cl
COc1ccc(cc1Cl)N1C(=O)NC(=O)C(=Cc2ccc(o2)(N+)(=O)(O))C1=O
InChI=1SC16H10ClN3O7c12612428(611(12)17)1915(22)10(14(21)1816(19)23)793513(279)20(24)25h27H1H3(H182123)b107
MFCD03673372
ZINC000005024350
ZINC5024350
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