Vitas-M small molecule compound
methyl 2-{[N-(2-ethoxyphenyl)-N-(methylsulfonyl)glycyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK916058
SMILES CCOc1ccccc1N(S(=O)(=O)C)CC(=O)Nc1sc2c(c1C(=O)OC)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 C21H26N2O6S2 MW 466.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O6S2/c1-4-29-16-11-7-6-10-15(16)23(31(3,26)27)13-18(24)22-20-19(21(25)28-2)14-9-5-8-12-17(14)30-20/h6-7,10-11H,4-5,8-9,12-13H2,1-3H3,(H,22,24)InChIKey
QGKBIVVPDVCYIB-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC=C1N(CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC)S(=O)(=O)C
InChI=1SC21H26N2O6S2c14291611761015(16)23(31(326)27)1318(24)222019(21(25)282)149581217(14)3020h671011H45891213H213H3(H2224)
methyl2((2(2ethoxyNmethylsulfonylanilino)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((N(2ethoxyphenyl)N(methylsulfonyl)glycyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD03997807
ZINC000001142100
ZINC01142100
ZINC1142100
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