Vitas-M small molecule compound
N-1,3-benzodioxol-5-yl-N~2~-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}-N~2~-(2-fluorobenzyl)glycinamide
Catalog ID
STL439072
SMILES O=C(CN(C(=O)CSc1nc(C)cc(n1)C)Cc1ccccc1F)Nc1ccc2c(c1)OCO2
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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 C24H23FN4O4S MW 482.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23FN4O4S/c1-15-9-16(2)27-24(26-15)34-13-23(31)29(11-17-5-3-4-6-19(17)25)12-22(30)28-18-7-8-20-21(10-18)33-14-32-20/h3-10H,11-14H2,1-2H3,(H,28,30)InChIKey
PTFHBPLVNZMDTP-UHFFFAOYSA-NSynonyms
CC1=CC(=NC(=N1)SCC(=O)N(CC2=CC=CC=C2F)CC(=O)NC3=CC4=C(C=C3)OCO4)C
InChI=1SC24H23FN4O4Sc115916(2)2724(2615)341323(31)29(1117534619(17)25)1222(30)2818782021(1018)33143220h310H1114H212H3(H2830)
MFCD09958452
N(13BENZODIOXOL5YL)2((2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)((2FLUOROPHENYL)METHYL)AMINO)ACETAMIDE
N(2(BENZO(D)(13)DIOXOL5YLAMINO)2OXOETHYL)2(46DIMETHYLPYRIMIDIN2YLTHIO)N(2FLUOROBENZYL)ACETAMIDE
N13benzodioxol5ylN~2~(((46dimethylpyrimidin2yl)sulfanyl)acetyl)N~2~(2fluorobenzyl)glycinamide
ZINC000001420412
ZINC1420412
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