Vitas-M small molecule compound
6-(2-methylbutan-2-yl)-2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK448555
SMILES CCC(C1CCc2c(C1)sc(c2C(=O)N)NC(=O)C12CC3CC(C2)CC(C1)C3)(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 C25H36N2O2S MW 428.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36N2O2S/c1-4-24(2,3)17-5-6-18-19(10-17)30-22(20(18)21(26)28)27-23(29)25-11-14-7-15(12-25)9-16(8-14)13-25/h14-17H,4-13H2,1-3H3,(H2,26,28)(H,27,29)InChIKey
CLQSTNBXINTVCK-UHFFFAOYSA-NSynonyms
2(adamantane1carbonylamino)6(2methylbutan2yl)4567tetrahydro1benzothiophene3carboxamide
6(2methylbutan2yl)2((tricyclo(3311~37~)dec1ylcarbonyl)amino)4567tetrahydro1benzothiophene3carboxamide
CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C34CC5CC(C3)CC(C5)C4
InChI=1SC25H36N2O2Sc1424(23)17561819(1017)3022(20(18)21(26)28)2723(29)251114715(1225)916(814)1325h1417H413H213H3(H22628)(H2729)
ZINC000004177326
ZINC000004177327
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