Vitas-M small molecule compound
6-(4-chloro-3-methyl-1H-pyrazol-5-yl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL318395
SMILES Cc1nn(c(c1c1nnc2n1nc(s2)c1[nH]nc(c1Cl)C)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 C13H13ClN8S MW 348.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13ClN8S/c1-5-8(7(3)21(4)19-5)11-17-18-13-22(11)20-12(23-13)10-9(14)6(2)15-16-10/h1-4H3,(H,15,16)InChIKey
CEOFSGPAUAKJMI-UHFFFAOYSA-NSynonyms
1574288-18-81574288188
6(4chloro3methyl1Hpyrazol5yl)3(135trimethyl1Hpyrazol4yl)(124)triazolo(34b)(134)thiadiazole
6(4chloro5methyl1Hpyrazol3yl)3(135trimethyl1Hpyrazol4yl)(124)triazolo(34b)(134)thiadiazole
6(4chloro5methyl1Hpyrazol3yl)3(135trimethylpyrazol4yl)(124)triazolo(34b)(134)thiadiazole
CC1=C(C(=NN1)C2=NN3C(=NN=C3S2)C4=C(N(N=C4C)C)C)Cl
Cc1nn(c(c1c1nnc2n1nc(s2)c1(nH)nc(c1Cl)C)C)C
Cc1nn(c(c1c1nnc2n1nc(s2)c1n(nH)c(c1Cl)C)C)C
InChI=1SC13H13ClN8Sc158(7(3)21(4)195)1117181322(11)2012(2313)109(14)6(2)151610h14H3(H1516)
MFCD28031263
ZINC000095479261
ZINC95479261
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