Vitas-M small molecule compound
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[5-(2,4-dichlorophenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK118525
SMILES N#Cc1c(NC(=O)CSc2nnc(n2CC)c2ccc(cc2Cl)Cl)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 C21H19Cl2N5OS2 MW 492.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl2N5OS2/c1-2-28-19(14-8-7-12(22)9-16(14)23)26-27-21(28)30-11-18(29)25-20-15(10-24)13-5-3-4-6-17(13)31-20/h7-9H,2-6,11H2,1H3,(H,25,29)InChIKey
PNQYFYWCWRHOFR-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=C(C3=C(S2)CCCC3)C#N)C4=C(C=C(C=C4)Cl)Cl
InChI=1SC21H19Cl2N5OS2c122819(148712(22)916(14)23)262721(28)301118(29)252015(1024)13534617(13)3120h79H2611H21H3(H2529)
MFCD04127764
N(3cyano4567tetrahydro1benzothiophen2yl)2((5(24dichlorophenyl)4ethyl124triazol3yl)sulfanyl)acetamide
N(3cyano4567tetrahydro1benzothiophen2yl)2((5(24dichlorophenyl)4ethyl4H124triazol3yl)sulfanyl)acetamide
ZINC000009305001
ZINC09305001
ZINC9305001
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