Vitas-M small molecule compound
ethyl 2-{[(3-methylphenyl)carbamothioyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK829853
SMILES CCOC(=O)c1c(NC(=S)Nc2cccc(c2)C)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 C19H22N2O2S2 MW 374.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O2S2/c1-3-23-18(22)16-14-9-4-5-10-15(14)25-17(16)21-19(24)20-13-8-6-7-12(2)11-13/h6-8,11H,3-5,9-10H2,1-2H3,(H2,20,21,24)InChIKey
HBQCKFQEPIINNM-UHFFFAOYSA-NSynonyms
59898-54-359898543
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=S)NC3=CC=CC(=C3)C
ethyl2(((3methylphenyl)carbamothioyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((3methylphenyl)carbamothioylamino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(3(mtolyl)thioureido)4567tetrahydrobenzo(b)thiophene3carboxylate
InChI=1SC19H22N2O2S2c132318(22)16149451015(14)2517(16)2119(24)201386712(2)1113h6811H35910H212H3(H2202124)
MFCD03285544
ZINC000001123691
ZINC01123691
ZINC1123691
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