Vitas-M small molecule compound
3-(4-ethyl-5-methylthiophen-3-yl)-4-methyl-5-{[(4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-4H-1,2,4-triazole
Catalog ID
STK466804
SMILES CCc1c(C)scc1c1nnc(n1C)SCn1ncc(c1)[N+](=O)[O-]
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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 C14H16N6O2S2 MW 364.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N6O2S2/c1-4-11-9(2)23-7-12(11)13-16-17-14(18(13)3)24-8-19-6-10(5-15-19)20(21)22/h5-7H,4,8H2,1-3H3InChIKey
ZUSBPUDBXQDFFG-UHFFFAOYSA-NSynonyms
3(4ETHYL5METHYL(3THIENYL))4METHYL5((4NITROPYRAZOLYL)METHYLTHIO)124TRIAZOLE
3(4ethyl5methylthiophen3yl)4methyl5(((4nitro1Hpyrazol1yl)methyl)sulfanyl)4H124triazole
3(4ethyl5methylthiophen3yl)4methyl5((4nitropyrazol1yl)methylsulfanyl)124triazole
CCC1=C(SC=C1C2=NN=C(N2C)SCN3C=C(C=N3)(N+)(=O)(O))C
CCc1c(C)scc1c1nnc(n1C)SCn1ncc(c1)(N+)(=O)(O)
InChI=1SC14H16N6O2S2c14119(2)23712(11)13161714(18(13)3)24819610(51519)20(21)22h57H48H213H3
MFCD06106691
ZINC000017074911
ZINC17074911
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