Vitas-M small molecule compound
4-methyl-3-(5-methylthiophen-3-yl)-5-{[(4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-4H-1,2,4-triazole
Catalog ID
STK464752
SMILES Cc1scc(c1)c1nnc(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 C12H12N6O2S2 MW 336.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N6O2S2/c1-8-3-9(6-21-8)11-14-15-12(16(11)2)22-7-17-5-10(4-13-17)18(19)20/h3-6H,7H2,1-2H3InChIKey
JIWQKJPOVNYRRE-UHFFFAOYSA-NSynonyms
4methyl3(5methylthiophen3yl)5(((4nitro1Hpyrazol1yl)methyl)sulfanyl)4H124triazole
4methyl3(5methylthiophen3yl)5((4nitropyrazol1yl)methylsulfanyl)124triazole
4METHYL5(5METHYL(3THIENYL))3((4NITROPYRAZOLYL)METHYLTHIO)124TRIAZOLE
CC1=CC(=CS1)C2=NN=C(N2C)SCN3C=C(C=N3)(N+)(=O)(O)
Cc1scc(c1)c1nnc(n1C)SCn1ncc(c1)(N+)(=O)(O)
InChI=1SC12H12N6O2S2c1839(6218)11141512(16(11)2)22717510(41317)18(19)20h36H7H212H3
MFCD06048655
ZINC000017070711
ZINC17070711
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