Vitas-M small molecule compound
ethyl 2-[(phenylcarbamothioyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK391331
SMILES CCOC(=O)c1c(NC(=S)Nc2ccccc2)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 C18H20N2O2S2 MW 360.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2O2S2/c1-2-22-17(21)15-13-10-6-7-11-14(13)24-16(15)20-18(23)19-12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11H2,1H3,(H2,19,20,23)InChIKey
LLGKQAVFOOLYNJ-UHFFFAOYSA-NSynonyms
42076-12-042076120
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC3=CC=CC=C3
ethyl2((phenylcarbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(3phenylthioureido)4567tetrahydrobenzo(b)thiophene3carboxylate
ethyl2(phenylcarbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC18H20N2O2S2c122217(21)151310671114(13)2416(15)2018(23)19128435912h3589H2671011H21H3(H2192023)
MFCD00128359
ZINC000005092019
ZINC05092019
ZINC5092019
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