Vitas-M small molecule compound
N-({[(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-D-valine
Catalog ID
STK604951
SMILES O=C(N[C@@H](C(=O)O)C(C)C)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 C20H19NO6S MW 401.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO6S/c1-11(2)18(20(24)25)21-17(22)10-26-12-5-6-14-15(8-12)27-16(19(14)23)9-13-4-3-7-28-13/h3-9,11,18H,10H2,1-2H3,(H,21,22)(H,24,25)/b16-9-/t18-/m1/s1InChIKey
QSKCVGHRNXVEJM-YZIPPPLESA-NSynonyms
1173683-77-6(2R)3METHYL2((2(((2Z)3OXO2(THIOPHEN2YLMETHYLIDENE)1BENZOFURAN6YL)OXY)ACETYL)AMINO)BUTANOICACID
(SZ)3methyl2(2((3oxo2(thiophen2ylmethylene)23dihydrobenzofuran6yl)oxy)acetamido)butanoicacid
1173683776
CC(C)C(C(=O)O)NC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=CC=CS3)O2
InChI=1SC20H19NO6Sc111(2)18(20(24)25)2117(22)102612561415(812)2716(19(14)23)9134372813h391118H10H212H3(H2122)(H2425)b169t18m1s1
MFCD06776590
N((((2Z)3oxo2(thiophen2ylmethylidene)23dihydro1benzofuran6yl)oxy)acetyl)Dvaline
O=C(N(C@@H)(C(=O)O)C(C)C)COc1ccc2c(c1)OC(=Cc1cccs1)C2=O
O=C(N(C@H)(C(=O)O)C(C)C)COc1ccc2c(c1)OC(=Cc1cccs1)C2=O
ZINC000006659536
ZINC6659536
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.