Vitas-M small molecule compound

2-(methylsulfanyl)-6-nitro-1,3-benzoxazole

Catalog ID
STK836318
SMILES CSc1nc2c(o1)cc(cc2)[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 C8H6N2O3S MW 210.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H6N2O3S/c1-14-8-9-6-3-2-5(10(11)12)4-7(6)13-8/h2-4H,1H3
InChIKey
SMPNPJSWVLTCKE-UHFFFAOYSA-N
Synonyms
101084-55-3
101084553
2(methylsulfanyl)6nitro13benzoxazole
2(methylthio)6nitrobenzo(d)oxazole
2METHYLSULFANYL6NITRO13BENZOXAZOLE
2METHYLSULFANYL6NITROBENZOOXAZOLE
2METHYLTHIO6NITROBENZOXAZOLE
CSC1=NC2=C(O1)C=C(C=C2)(N+)(=O)(O)
CSc1nc2c(o1)cc(cc2)(N+)(=O)(O)
InChI=1SC8H6N2O3Sc114896325(10(11)12)47(6)138h24H1H3
MFCD00600605
ZINC000000174888
ZINC00174888
ZINC174888

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.