Vitas-M small molecule compound
ethyl 2-[(thiocyanatoacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK746986
SMILES N#CSCC(=O)Nc1sc2c(c1C(=O)OCC)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 C14H16N2O3S2 MW 324.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N2O3S2/c1-2-19-14(18)12-9-5-3-4-6-10(9)21-13(12)16-11(17)7-20-8-15/h2-7H2,1H3,(H,16,17)InChIKey
QJJPHFQGAVGGHJ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSC#N
ethyl2((2thiocyanatoacetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((thiocyanatoacetyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC14H16N2O3S2c121914(18)129534610(9)2113(12)1611(17)720815h27H21H3(H1617)
MFCD00741953
ZINC000002176601
ZINC02176601
ZINC2176601
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