Vitas-M small molecule compound
methyl 2-{[(6-methyl-1-benzofuran-3-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK908035
SMILES COC(=O)c1c(NC(=O)Cc2coc3c2ccc(c3)C)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 C21H21NO4S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO4S/c1-12-7-8-14-13(11-26-16(14)9-12)10-18(23)22-20-19(21(24)25-2)15-5-3-4-6-17(15)27-20/h7-9,11H,3-6,10H2,1-2H3,(H,22,23)InChIKey
YEDMLBWUZMPDDH-UHFFFAOYSA-NSynonyms
CC1=CC2=C(C=C1)C(=CO2)CC(=O)NC3=C(C4=C(S3)CCCC4)C(=O)OC
InChI=1SC21H21NO4Sc112781413(112616(14)912)1018(23)222019(21(24)252)15534617(15)2720h7911H3610H212H3(H2223)
methyl2(((6methyl1benzofuran3yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2(6methyl1benzofuran3yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD06647546
ZINC000006809927
ZINC06809927
ZINC6809927
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