Vitas-M small molecule compound
N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2,2-dimethylpropanamide
Catalog ID
STK080652
SMILES CCC(C1CCc2c(C1)sc(c2C#N)NC(=O)C(C)(C)C)(C)C
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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 C19H28N2OS MW 332.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H28N2OS/c1-7-19(5,6)12-8-9-13-14(11-20)16(23-15(13)10-12)21-17(22)18(2,3)4/h12H,7-10H2,1-6H3,(H,21,22)InChIKey
IXBBUWGNUHTEJP-UHFFFAOYSA-NSynonyms
CCC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)C(C)(C)C
CCC(C1CCc2c(C1)sc(c2C#N)NC(=O)C(C)(C)C)(C)C
InChI=1SC19H28N2OSc1719(56)12891314(1120)16(2315(13)1012)2117(22)18(23)4h12H710H216H3(H2122)
MFCD03064279
N(3cyano6(2methylbutan2yl)4567tetrahydro1benzothiophen2yl)22dimethylpropanamide
STK080652
ZINC000000485047
ZINC000000485048
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