Vitas-M small molecule compound
2-({5-[(4-chloro-2-methylphenoxy)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Catalog ID
STK239990
SMILES N#Cc1c(NC(=O)CSc2nnc(o2)COc2ccc(cc2C)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 C21H19ClN4O3S2 MW 474.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN4O3S2/c1-12-8-13(22)6-7-16(12)28-10-19-25-26-21(29-19)30-11-18(27)24-20-15(9-23)14-4-2-3-5-17(14)31-20/h6-8H,2-5,10-11H2,1H3,(H,24,27)InChIKey
JEDHXQYGPHAQEK-UHFFFAOYSA-NSynonyms
2((5((4chloro2methylphenoxy)methyl)134oxadiazol2yl)sulfanyl)N(3cyano4567tetrahydro1benzothiophen2yl)acetamide
CC1=C(C=CC(=C1)Cl)OCC2=NN=C(O2)SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N
InChI=1SC21H19ClN4O3S2c112813(22)6716(12)281019252621(2919)301118(27)242015(923)14423517(14)3120h68H251011H21H3(H2427)
MFCD08677692
ZINC000009226292
ZINC09226292
ZINC9226292
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Check stock on Vitas-MAvailable files
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