Vitas-M small molecule compound
5-[{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}(methylamino)methylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STK207898
SMILES CNC(=C1C(=O)N(C)C(=O)N(C1=O)C)SCc1cc2OCOc2cc1Cl
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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 C16H16ClN3O5S MW 397.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN3O5S/c1-18-13(12-14(21)19(2)16(23)20(3)15(12)22)26-6-8-4-10-11(5-9(8)17)25-7-24-10/h4-5,18H,6-7H2,1-3H3InChIKey
ZYSDKWCAWCJYGL-UHFFFAOYSA-NSynonyms
5((((6chloro13benzodioxol5yl)methyl)sulfanyl)(methylamino)methylidene)13dimethylpyrimidine246(1H3H5H)trione
5((((6chlorobenzo(d)(13)dioxol5yl)methyl)thio)(methylamino)methylene)13dimethylpyrimidine246(1H3H5H)trione
5(((6CHLORO(2HBENZO(D)13DIOXOLAN5YL))METHYLTHIO)(METHYLAMINO)METHYLENE)13DIMETHYL13DIHYDROPYRIMIDINE246TRIONE
5((6chloro13benzodioxol5yl)methylsulfanyl(methylamino)methylidene)13dimethyl13diazinane246trione
CNC(=C1C(=O)N(C(=O)N(C1=O)C)C)SCC2=CC3=C(C=C2Cl)OCO3
InChI=1SC16H16ClN3O5Sc11813(1214(21)19(2)16(23)20(3)15(12)22)266841011(59(8)17)2572410h4518H67H213H3
MFCD06599177
ZINC000004294884
ZINC04294884
ZINC4294884
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