Vitas-M small molecule compound
methyl 2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK960574
SMILES COC(=O)c1c(NC(=O)CC23CC4CC(C3)CC(C2)C4)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 C22H29NO3S MW 387.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29NO3S/c1-26-21(25)19-16-4-2-3-5-17(16)27-20(19)23-18(24)12-22-9-13-6-14(10-22)8-15(7-13)11-22/h13-15H,2-12H2,1H3,(H,23,24)InChIKey
PQIFTTCKHRZELS-UHFFFAOYSA-NSynonyms
676153-74-5676153745
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)CC34CC5CC(C3)CC(C5)C4
InChI=1SC22H29NO3Sc12621(25)1916423517(16)2720(19)2318(24)1222913614(1022)815(713)1122h1315H212H21H3(H2324)
methyl2((2(1adamantyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((tricyclo(3311~37~)dec1ylacetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000005660466
ZINC05660466
ZINC5660466
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