Vitas-M small molecule compound
1-({[(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)piperidine-4-carboxylic acid
Catalog ID
STK616817
SMILES OC(=O)C1CCN(CC1)C(=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 C21H19NO6S MW 413.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO6S/c23-19(22-7-5-13(6-8-22)21(25)26)12-27-14-3-4-16-17(10-14)28-18(20(16)24)11-15-2-1-9-29-15/h1-4,9-11,13H,5-8,12H2,(H,25,26)/b18-11-InChIKey
CFXSZZATDAITGU-WQRHYEAKSA-NSynonyms
900893-26-7(Z)1(2((3oxo2(thiophen2ylmethylene)23dihydrobenzofuran6yl)oxy)acetyl)piperidine4carboxylicacid
1((((2Z)3oxo2(thiophen2ylmethylidene)23dihydro1benzofuran6yl)oxy)acetyl)piperidine4carboxylicacid
1(2(((2Z)3OXO2(THIOPHEN2YLMETHYLIDENE)1BENZOFURAN6YL)OXY)ACETYL)PIPERIDINE4CARBOXYLICACID
900893267
C1CN(CCC1C(=O)O)C(=O)COC2=CC3=C(C=C2)C(=O)C(=CC4=CC=CS4)O3
InChI=1SC21H19NO6Sc2319(227513(6822)21(25)26)122714341617(1014)2818(20(16)24)11152192915h1491113H5812H2(H2526)b1811
MFCD06779557
OC(=O)C1CCN(CC1)C(=O)COc1ccc2c(c1)OC(=Cc1cccs1)C2=O
ZINC000006659865
ZINC6659865
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