Vitas-M small molecule compound
5-{[(3-chloro-4-methylphenyl)amino]methylidene}-2,2-dimethyl-1,3-dioxane-4,6-dione
Catalog ID
STK004670
SMILES O=C1OC(C)(C)OC(=O)C1=CNc1ccc(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 C14H14ClNO4 MW 295.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14ClNO4/c1-8-4-5-9(6-11(8)15)16-7-10-12(17)19-14(2,3)20-13(10)18/h4-7,16H,1-3H3InChIKey
GPHWIWWCAOXNJU-UHFFFAOYSA-NSynonyms
5(((3CHLORO4METHYLPHENYL)AMINO)METHYLIDENE)22DIMETHYL13DIOXANE46DIONE
5((3CHLORO4METHYLANILINO)METHYLIDENE)22DIMETHYL13DIOXANE46DIONE
CC1=C(C=C(C=C1)NC=C2C(=O)OC(OC2=O)(C)C)Cl
InChI=1SC14H14ClNO4c18459(611(8)15)1671012(17)1914(23)2013(10)18h4716H13H3
MFCD00491971
O=C1OC(C)(C)OC(=O)C1=CNc1ccc(c(c1)Cl)C
STK004670
ZINC000000342774
ZINC00342774
ZINC342774
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