Vitas-M small molecule compound
4-{[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-yn-1-yl 4-bromobenzoate
Catalog ID
STK124033
SMILES Brc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)c1ccc(cc1)[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 C19H12BrN3O5S MW 474.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12BrN3O5S/c20-15-7-3-14(4-8-15)18(24)27-11-1-2-12-29-19-22-21-17(28-19)13-5-9-16(10-6-13)23(25)26/h3-10H,11-12H2InChIKey
HNWQHUKOOMXDRX-UHFFFAOYSA-NSynonyms
669716-22-74((5(4NITROPHENYL)134OXADIAZOL2YL)SULFANYL)BUT2YN1YL4BROMOBENZOATE
4((5(4NITROPHENYL)134OXADIAZOL2YL)SULFANYL)BUT2YNYL4BROMOBENZOATE
4((5(4nitrophenyl)134oxadiazol2yl)thio)but2yn1yl4bromobenzoate
669716227
Brc1ccc(cc1)C(=O)OCC#CCSc1nnc(o1)c1ccc(cc1)(N+)(=O)(O)
C1=CC(=CC=C1C2=NN=C(O2)SCC#CCOC(=O)C3=CC=C(C=C3)Br)(N+)(=O)(O)
InChI=1SC19H12BrN3O5Sc20157314(4815)18(24)271112122919222117(2819)135916(10613)23(25)26h310H1112H2
MFCD04004801
ZINC000001850857
ZINC01850857
ZINC1850857
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