Vitas-M small molecule compound
4-{[5-(4-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-yn-1-yl 4-nitrobenzoate
Catalog ID
STK087482
SMILES Brc1ccc(cc1)c1nnc(o1)SCC#CCOC(=O)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/c20-15-7-3-13(4-8-15)17-21-22-19(28-17)29-12-2-1-11-27-18(24)14-5-9-16(10-6-14)23(25)26/h3-10H,11-12H2InChIKey
IGCNWERWDAJUTN-UHFFFAOYSA-NSynonyms
4((5(4BROMOPHENYL)134OXADIAZOL2YL)SULFANYL)BUT2YN1YL4NITROBENZOATE
4((5(4BROMOPHENYL)134OXADIAZOL2YL)SULFANYL)BUT2YNYL4NITROBENZOATE
Brc1ccc(cc1)c1nnc(o1)SCC#CCOC(=O)c1ccc(cc1)(N+)(=O)(O)
C1=CC(=CC=C1C2=NN=C(O2)SCC#CCOC(=O)C3=CC=C(C=C3)(N+)(=O)(O))Br
InChI=1SC19H12BrN3O5Sc20157313(4815)17212219(2817)291221112718(24)145916(10614)23(25)26h310H1112H2
MFCD03247808
STK087482
ZINC000013894129
ZINC13894129
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