Vitas-M small molecule compound
(5E)-5-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-1-(3,4-dimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK176677
SMILES O=C1NC(=O)N(C(=O)/C/1=C/c1cc2OCOc2cc1Cl)c1ccc(c(c1)C)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 C20H15ClN2O5 MW 398.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN2O5/c1-10-3-4-13(5-11(10)2)23-19(25)14(18(24)22-20(23)26)6-12-7-16-17(8-15(12)21)28-9-27-16/h3-8H,9H2,1-2H3,(H,22,24,26)/b14-6+InChIKey
ZFYPTFMLOPEREI-MKMNVTDBSA-NSynonyms
(5E)5((6CHLORO13BENZODIOXOL5YL)METHYLIDENE)1(34DIMETHYLPHENYL)13DIAZINANE246TRIONE
(5E)5((6CHLORO13BENZODIOXOL5YL)METHYLIDENE)1(34DIMETHYLPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC4=C(C=C3Cl)OCO4)C(=O)NC2=O)C
InChI=1SC20H15ClN2O5c1103413(511(10)2)2319(25)14(18(24)2220(23)26)61271617(815(12)21)2892716h38H9H212H3(H222426)b146+
MFCD02611698
O=C1NC(=O)N(C(=O)C1=Cc1cc2OCOc2cc1Cl)c1ccc(c(c1)C)C
ZINC000001186228
ZINC01186228
ZINC1186228
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