Vitas-M small molecule compound
methyl 4-({[3-(1,3-benzodioxol-5-ylmethyl)-1-methyl-5-oxo-2-thioxoimidazolidin-4-yl]acetyl}amino)benzoate
Catalog ID
STL257397
SMILES COC(=O)c1ccc(cc1)NC(=O)CC1N(Cc2ccc3c(c2)OCO3)C(=S)N(C1=O)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 C22H21N3O6S MW 455.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O6S/c1-24-20(27)16(10-19(26)23-15-6-4-14(5-7-15)21(28)29-2)25(22(24)32)11-13-3-8-17-18(9-13)31-12-30-17/h3-9,16H,10-12H2,1-2H3,(H,23,26)InChIKey
GYPUBUVQSFOMFE-UHFFFAOYSA-NSynonyms
1093412-76-01093412760
CN1C(=O)C(N(C1=S)CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=C(C=C4)C(=O)OC
InChI=1SC22H21N3O6Sc12420(27)16(1019(26)23156414(5715)21(28)292)25(22(24)32)1113381718(913)31123017h3916H1012H212H3(H2326)
methyl4(((3(13benzodioxol5ylmethyl)1methyl5oxo2thioxoimidazolidin4yl)acetyl)amino)benzoate
METHYL4((2(3(13BENZODIOXOL5YLMETHYL)1METHYL5OXO2SULFANYLIDENEIMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
methyl4(2(3(benzo(d)(13)dioxol5ylmethyl)1methyl5oxo2thioxoimidazolidin4yl)acetamido)benzoate
MFCD03042528
ZINC000000884424
ZINC000000884426
ZINC00884424
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