Vitas-M small molecule compound
methyl 2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK315362
SMILES COC(=O)c1c(sc2c1CCCC2)NC(=O)C12CC3CC(C2)CC(C1)C3
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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 C21H27NO3S MW 373.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27NO3S/c1-25-19(23)17-15-4-2-3-5-16(15)26-18(17)22-20(24)21-9-12-6-13(10-21)8-14(7-12)11-21/h12-14H,2-11H2,1H3,(H,22,24)InChIKey
ZHEACADVKZWGIG-UHFFFAOYSA-NSynonyms
333396-75-1333396751
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C34CC5CC(C3)CC(C5)C4
InChI=1SC21H27NO3Sc12519(23)1715423516(15)2618(17)2220(24)21912613(1021)814(712)1121h1214H211H21H3(H2224)
methyl2((tricyclo(3311~37~)dec1ylcarbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2(adamantane1carbonylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD01918815
ZINC000004610865
ZINC04610865
ZINC4610865
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