Vitas-M small molecule compound
N-(1-hydroxy-3-methylpentan-2-yl)-2-{[(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetamide
Catalog ID
STL350625
SMILES OCC(C(CC)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 C21H23NO5S MW 401.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO5S/c1-3-13(2)17(11-23)22-20(24)12-26-14-6-7-16-18(9-14)27-19(21(16)25)10-15-5-4-8-28-15/h4-10,13,17,23H,3,11-12H2,1-2H3,(H,22,24)/b19-10-InChIKey
UYVVYSKBVKKBGQ-GRSHGNNSSA-NSynonyms
CCC(C)C(CO)NC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=CC=CS3)O2
InChI=1SC21H23NO5Sc1313(2)17(1123)2220(24)122614671618(914)2719(21(16)25)10155482815h410131723H31112H212H3(H2224)b1910
MFCD28032364
N((2S)1hydroxy3methylpentan2yl)2(((Z)3oxo2(thiophen2ylmethylene)23dihydrobenzofuran6yl)oxy)acetamide
N(1hydroxy3methylpentan2yl)2(((2Z)3oxo2(thiophen2ylmethylidene)1benzofuran6yl)oxy)acetamide
N(1hydroxy3methylpentan2yl)2(((2Z)3oxo2(thiophen2ylmethylidene)23dihydro1benzofuran6yl)oxy)acetamide
OC(C@H)(C(CC)C)NC(=O)COc1ccc2c(c1)OC(=Cc1cccs1)C2=O
OCC(C(CC)C)NC(=O)COc1ccc2c(c1)OC(=Cc1cccs1)C2=O
ZINC000008992409
ZINC000095471306
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