Vitas-M small molecule compound
methyl 3-isothiocyanatothiophene-2-carboxylate
Catalog ID
STL185520
SMILES S=C=Nc1ccsc1C(=O)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 C7H5NO2S2 MW 199.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H5NO2S2/c1-10-7(9)6-5(8-4-11)2-3-12-6/h2-3H,1H3InChIKey
RKBLURUDWDTMOB-UHFFFAOYSA-NSynonyms
81321-10-02THIOPHENECARBOXYLICACID3ISOTHIOCYANATOMETHYLESTER
3ISOTHIOCYANATO2THIOPHENECARBOXYLICACIDMETHYLESTER
81321100
COC(=O)C1=C(C=CS1)N=C=S
InChI=1SC7H5NO2S2c1107(9)65(8411)23126h23H1H3
METHYL3ISOISOTHIOCYANATOTHIOPHENE2CARBOXYLATE
METHYL3ISOTHIOCYANATO2THIOPHENECARBOXYLATE
methyl3isothiocyanatothiophene2carboxylate
MFCD00052589
ZINC000000159908
ZINC00159908
ZINC159908
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