Vitas-M small molecule compound
3,3-dimethyl-1-{[4-methyl-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}butan-2-one
Catalog ID
STL151406
SMILES O=C(C(C)(C)C)CSc1nnc(n1C)c1cccnc1
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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 C14H18N4OS MW 290.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N4OS/c1-14(2,3)11(19)9-20-13-17-16-12(18(13)4)10-6-5-7-15-8-10/h5-8H,9H2,1-4H3InChIKey
OYLRUSJTJCLCSA-UHFFFAOYSA-NSynonyms
578697-24-233DIMETHYL1((4METHYL5(PYRIDIN3YL)4H124TRIAZOL3YL)SULFANYL)BUTAN2ONE
33dimethyl1((4methyl5(pyridin3yl)4H124triazol3yl)thio)butan2one
33DIMETHYL1((4METHYL5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)BUTAN2ONE
578697242
CC(C)(C)C(=O)CSC1=NN=C(N1C)C2=CN=CC=C2
InChI=1SC14H18N4OSc114(23)11(19)92013171612(18(13)4)1065715810h58H9H214H3
MFCD04028968
ZINC000000532204
ZINC00532204
ZINC532204
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