Vitas-M small molecule compound
ethyl 2-{[(3-butoxyphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK324881
SMILES CCCCOc1cccc(c1)C(=O)Nc1sc2c(c1C(=O)OCC)CCCC2
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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 C22H27NO4S MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO4S/c1-3-5-13-27-16-10-8-9-15(14-16)20(24)23-21-19(22(25)26-4-2)17-11-6-7-12-18(17)28-21/h8-10,14H,3-7,11-13H2,1-2H3,(H,23,24)InChIKey
GPSCRVUCZALRGI-UHFFFAOYSA-NSynonyms
CCCCOC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OCC
ethyl2(((3butoxyphenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((3butoxybenzoyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC22H27NO4Sc135132716108915(1416)20(24)232119(22(25)2642)1711671218(17)2821h81014H371113H212H3(H2324)
MFCD01063811
ZINC000002062628
ZINC02062628
ZINC2062628
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