Vitas-M small molecule compound
methyl 2-isothiocyanato-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK437179
SMILES S=C=Nc1sc2c(c1C(=O)OC)CCCC2
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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 C11H11NO2S2 MW 253.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11NO2S2/c1-14-11(13)9-7-4-2-3-5-8(7)16-10(9)12-6-15/h2-5H2,1H3InChIKey
JKVSSDPOTCLFKE-UHFFFAOYSA-NSynonyms
588694-54-6588694546
COC(=O)C1=C(SC2=C1CCCC2)N=C=S
InChI=1SC11H11NO2S2c11411(13)9742358(7)1610(9)12615h25H21H3
methyl2isothiocyanato4567tetrahydro1benzothiophene3carboxylate
MFCD03944540
ZINC000002522243
ZINC02522243
ZINC2522243
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