Vitas-M small molecule compound
2-[(5-benzyl-4-hydroxy-6-methylpyrimidin-2-yl)sulfanyl]-N-(4-methoxy-2-nitrophenyl)acetamide
Catalog ID
STK328736
SMILES COc1ccc(c(c1)[N+](=O)[O-])NC(=O)CSc1nc(C)c(c(n1)O)Cc1ccccc1
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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 C21H20N4O5S MW 440.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O5S/c1-13-16(10-14-6-4-3-5-7-14)20(27)24-21(22-13)31-12-19(26)23-17-9-8-15(30-2)11-18(17)25(28)29/h3-9,11H,10,12H2,1-2H3,(H,23,26)(H,22,24,27)InChIKey
CWKYOWWFJFIHSP-UHFFFAOYSA-NSynonyms
727419-78-52((5benzyl4hydroxy6methylpyrimidin2yl)sulfanyl)N(4methoxy2nitrophenyl)acetamide
2((5BENZYL6METHYL4OXO1HPYRIMIDIN2YL)SULFANYL)N(4METHOXY2NITROPHENYL)ACETAMIDE
727419785
CC1=C(C(=O)N=C(N1)SCC(=O)NC2=C(C=C(C=C2)OC)(N+)(=O)(O))CC3=CC=CC=C3
COc1ccc(c(c1)(N+)(=O)(O))NC(=O)CSc1nc(C)c(c(n1)O)Cc1ccccc1
InChI=1SC21H20N4O5Sc11316(10146435714)20(27)2421(2213)311219(26)23179815(302)1118(17)25(28)29h3911H1012H212H3(H2326)(H222427)
MFCD05858916
ZINC000013644271
ZINC13644271
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