Vitas-M small molecule compound
methyl 6-tert-butyl-2-{[(4-chlorophenoxy)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK426776
SMILES COC(=O)c1c(NC(=O)COc2ccc(cc2)Cl)sc2c1CCC(C2)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 C22H26ClNO4S MW 435.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26ClNO4S/c1-22(2,3)13-5-10-16-17(11-13)29-20(19(16)21(26)27-4)24-18(25)12-28-15-8-6-14(23)7-9-15/h6-9,13H,5,10-12H2,1-4H3,(H,24,25)InChIKey
DFYWFTXMTIWCNU-UHFFFAOYSA-NSynonyms
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)COC3=CC=C(C=C3)Cl
InChI=1SC22H26ClNO4Sc122(23)135101617(1113)2920(19(16)21(26)274)2418(25)1228158614(23)7915h6913H51012H214H3(H2425)
methyl6tertbutyl2(((4chlorophenoxy)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6tertbutyl2((2(4chlorophenoxy)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD01357606
ZINC000001944541
ZINC000001944542
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