Vitas-M small molecule compound
methyl 2-{[N-(3,4-difluorophenyl)-N-(methylsulfonyl)glycyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK728938
SMILES COC(=O)c1c(NC(=O)CN(S(=O)(=O)C)c2ccc(c(c2)F)F)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 C19H20F2N2O5S2 MW 458.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20F2N2O5S2/c1-28-19(25)17-12-5-3-4-6-15(12)29-18(17)22-16(24)10-23(30(2,26)27)11-7-8-13(20)14(21)9-11/h7-9H,3-6,10H2,1-2H3,(H,22,24)InChIKey
GRBMIUVOWPUAOY-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)CN(C3=CC(=C(C=C3)F)F)S(=O)(=O)C
InChI=1SC19H20F2N2O5S2c12819(25)1712534615(12)2918(17)2216(24)1023(30(226)27)117813(20)14(21)911h79H3610H212H3(H2224)
methyl2((2(34difluoroNmethylsulfonylanilino)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((N(34difluorophenyl)N(methylsulfonyl)glycyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD07800390
ZINC000012417727
ZINC12417727
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