Vitas-M small molecule compound
4-{[5-(naphthalen-1-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-yn-1-yl 4-nitrobenzoate
Catalog ID
STK522282
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])OCC#CCSc1nnc(o1)c1cccc2c1cccc2
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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 C23H15N3O5S MW 445.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15N3O5S/c27-22(17-10-12-18(13-11-17)26(28)29)30-14-3-4-15-32-23-25-24-21(31-23)20-9-5-7-16-6-1-2-8-19(16)20/h1-2,5-13H,14-15H2InChIKey
ORYITRVYHVEQKV-UHFFFAOYSA-NSynonyms
714934-06-24((5(naphthalen1yl)134oxadiazol2yl)sulfanyl)but2yn1yl4nitrobenzoate
4((5(naphthalen1yl)134oxadiazol2yl)thio)but2yn1yl4nitrobenzoate
4((5NAPHTHALEN1YL134OXADIAZOL2YL)SULFANYL)BUT2YNYL4NITROBENZOATE
714934062
C1=CC=C2C(=C1)C=CC=C2C3=NN=C(O3)SCC#CCOC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC23H15N3O5Sc2722(17101218(131117)26(28)29)301434153223252421(3123)2095716612819(16)20h12513H1415H2
MFCD04192891
O=C(c1ccc(cc1)(N+)(=O)(O))OCC#CCSc1nnc(o1)c1cccc2c1cccc2
ZINC000001898172
ZINC01898172
ZINC1898172
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