Vitas-M small molecule compound
2-({5-[(2-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Catalog ID
STK139866
SMILES N#Cc1c(NC(=O)CSc2nnc(n2CC)COc2ccccc2Cl)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 C22H22ClN5O2S2 MW 488.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN5O2S2/c1-2-28-19(12-30-17-9-5-4-8-16(17)23)26-27-22(28)31-13-20(29)25-21-15(11-24)14-7-3-6-10-18(14)32-21/h4-5,8-9H,2-3,6-7,10,12-13H2,1H3,(H,25,29)InChIKey
LRAJUPCYDZKVJK-UHFFFAOYSA-NSynonyms
2((5((2chlorophenoxy)methyl)4ethyl124triazol3yl)sulfanyl)N(3cyano4567tetrahydro1benzothiophen2yl)acetamide
2((5((2chlorophenoxy)methyl)4ethyl4H124triazol3yl)sulfanyl)N(3cyano4567tetrahydro1benzothiophen2yl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=C(C3=C(S2)CCCC3)C#N)COC4=CC=CC=C4Cl
InChI=1SC22H22ClN5O2S2c122819(123017954816(17)23)262722(28)311320(29)252115(1124)147361018(14)3221h4589H2367101213H21H3(H2529)
MFCD03996844
ZINC000001139892
ZINC01139892
ZINC1139892
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