Vitas-M small molecule compound
ethyl 2-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK436907
SMILES CCOC(=O)c1c(N=C=S)sc2c1CCCC2
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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 C12H13NO2S2 MW 267.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13NO2S2/c1-2-15-12(14)10-8-5-3-4-6-9(8)17-11(10)13-7-16/h2-6H2,1H3InChIKey
UGKJYSQOLXXTJG-UHFFFAOYSA-NSynonyms
85716-87-685716876
CCOC(=O)C1=C(SC2=C1CCCC2)N=C=S
ethyl2isothiocyanato4567tetrahydro1benzothiophene3carboxylate
InChI=1SC12H13NO2S2c121512(14)10853469(8)1711(10)13716h26H21H3
MFCD03086212
ZINC000000161819
ZINC00161819
ZINC161819
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