Vitas-M small molecule compound

3-{[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}dihydrofuran-2(3H)-one

Catalog ID
STK205342
SMILES O=C1OCCC1Sc1nnc(o1)c1cccc(c1)[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 C12H9N3O5S MW 307.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9N3O5S/c16-11-9(4-5-19-11)21-12-14-13-10(20-12)7-2-1-3-8(6-7)15(17)18/h1-3,6,9H,4-5H2
InChIKey
KSJIHJRYKYBCKD-UHFFFAOYSA-N
Synonyms

3((5(3NITROPHENYL)134OXADIAZOL2YL)SULFANYL)DIHYDROFURAN2(3H)ONE
3((5(3nitrophenyl)134oxadiazol2yl)sulfanyl)oxolan2one
C1COC(=O)C1SC2=NN=C(O2)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC12H9N3O5Sc16119(451911)2112141310(2012)72138(67)15(17)18h1369H45H2
MFCD04273749
O=C1OCCC1Sc1nnc(o1)c1cccc(c1)(N+)(=O)(O)
ZINC000004740803
ZINC000004740804

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Available files

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