Vitas-M small molecule compound
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-{[(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetamide
Catalog ID
STK619532
SMILES OC[C@H](C(C)C)NC(=O)COc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O
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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 C20H21NO5S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO5S/c1-12(2)16(10-22)21-19(23)11-25-13-5-6-15-17(8-13)26-18(20(15)24)9-14-4-3-7-27-14/h3-9,12,16,22H,10-11H2,1-2H3,(H,21,23)/b18-9-/t16-/m1/s1InChIKey
PKFBJEUOWHMEHI-BZMUBCNJSA-NSynonyms
1014410-48-0(SZ)N(1hydroxy3methylbutan2yl)2((3oxo2(thiophen2ylmethylene)23dihydrobenzofuran6yl)oxy)acetamide
1014410480
CC(C)C(CO)NC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=CC=CS3)O2
InChI=1SC20H21NO5Sc112(2)16(1022)2119(23)112513561517(813)2618(20(15)24)9144372714h39121622H1011H212H3(H2123)b189t16m1s1
MFCD09850289
N((2S)1hydroxy3methylbutan2yl)2(((2Z)3oxo2(thiophen2ylmethylidene)1benzofuran6yl)oxy)acetamide
N((2S)1hydroxy3methylbutan2yl)2(((2Z)3oxo2(thiophen2ylmethylidene)23dihydro1benzofuran6yl)oxy)acetamide
OC(C@H)(C(C)C)NC(=O)COc1ccc2c(c1)OC(=Cc1cccs1)C2=O
ZINC000013686214
ZINC13686214
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