Vitas-M small molecule compound
2-ethyl-5,7-dimethyl[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium
Catalog ID
STL326420
SMILES CCc1n[n+]2c(s1)nc(cc2C)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 C9H12N3S MW 194.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H12N3S/c1-4-8-11-12-7(3)5-6(2)10-9(12)13-8/h5H,4H2,1-3H3/q+1InChIKey
LTIXWQZLSVYQJQ-UHFFFAOYSA-NSynonyms
2ethyl57dimethyl(134)thiadiazolo(32a)pyrimidin4ium
2ETHYL57DIMETHYL(134)THIADIAZOLO(32A)PYRIMIDIN4YLIUM
2ETHYL57DIMETHYL134THIADIAZOLO(32A)PYRIMIDINE
CCC1=N(N+)2=C(C=C(N=C2S1)C)C
CCc1n(n+)2c(s1)nc(cc2C)C
InChI=1SC9H12N3Sc14811127(3)56(2)109(12)138h5H4H213H3q+1
MFCD00625847
ZINC000000124254
ZINC00124254
ZINC124254
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