Vitas-M small molecule compound

2-{[5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-(2-methylpropyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK303755
SMILES NC(=O)CSc1nnc(n1CC(C)C)c1cc(n(n1)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 C13H20N6OS MW 308.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H20N6OS/c1-8(2)6-19-12(10-5-9(3)18(4)17-10)15-16-13(19)21-7-11(14)20/h5,8H,6-7H2,1-4H3,(H2,14,20)
InChIKey
NAXYQDJRKNXLKQ-UHFFFAOYSA-N
Synonyms
1005579-49-6
1005579496
2((5(15dimethyl1Hpyrazol3yl)4(2methylpropyl)4H124triazol3yl)sulfanyl)acetamide
2((5(15dimethylpyrazol3yl)4(2methylpropyl)124triazol3yl)sulfanyl)acetamide
CC1=CC(=NN1C)C2=NN=C(N2CC(C)C)SCC(=O)N
InChI=1SC13H20N6OSc18(2)61912(1059(3)18(4)1710)151613(19)21711(14)20h58H67H214H3(H21420)
MFCD04055993
ZINC000002778320
ZINC02778320
ZINC2778320

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.