Vitas-M small molecule compound

1-(4-chloro-2,5-dimethoxyphenyl)-5-(methylsulfanyl)-1H-tetrazole

Catalog ID
STK868938
SMILES COc1cc(Cl)c(cc1n1nnnc1SC)OC

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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 C10H11ClN4O2S MW 286.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H11ClN4O2S/c1-16-8-5-7(9(17-2)4-6(8)11)15-10(18-3)12-13-14-15/h4-5H,1-3H3
InChIKey
MLUMFCVPBMHUEY-UHFFFAOYSA-N
Synonyms

1(4chloro25dimethoxyphenyl)5(methylsulfanyl)1Htetrazole
1(4CHLORO25DIMETHOXYPHENYL)5(METHYLTHIO)1HTETRAAZOLE
1(4CHLORO25DIMETHOXYPHENYL)5METHYLSULFANYL1HTETRAZOLE
1(4CHLORO25DIMETHOXYPHENYL)5METHYLSULFANYLTETRAZOLE
COC1=CC(=C(C=C1N2C(=NN=N2)SC)OC)Cl
InChI=1SC10H11ClN4O2Sc116857(9(172)46(8)11)1510(183)12131415h45H13H3
MFCD03722237
ZINC000000794143
ZINC00794143
ZINC794143

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Available files

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