Vitas-M small molecule compound
3,3-dimethyl-1-{[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}butan-2-one
Catalog ID
STK205344
SMILES [O-][N+](=O)c1cccc(c1)c1nnc(o1)SCC(=O)C(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 C14H15N3O4S MW 321.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N3O4S/c1-14(2,3)11(18)8-22-13-16-15-12(21-13)9-5-4-6-10(7-9)17(19)20/h4-7H,8H2,1-3H3InChIKey
MHUWBDPBPBESPA-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cccc(c1)c1nnc(o1)SCC(=O)C(C)(C)C
33DIMETHYL1((5(3NITROPHENYL)134OXADIAZOL2YL)SULFANYL)BUTAN2ONE
CC(C)(C)C(=O)CSC1=NN=C(O1)C2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC14H15N3O4Sc114(23)11(18)82213161512(2113)954610(79)17(19)20h47H8H213H3
MFCD04273775
ZINC000004740805
ZINC04740805
ZINC4740805
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