Vitas-M small molecule compound
1-{[5-(3-hydroxy-3-methylbut-1-yn-1-yl)thiophen-2-yl]carbonyl}piperidine-4-carboxylic acid
Catalog ID
STK685081
SMILES OC(=O)C1CCN(CC1)C(=O)c1ccc(s1)C#CC(O)(C)C
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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 C16H19NO4S MW 321.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19NO4S/c1-16(2,21)8-5-12-3-4-13(22-12)14(18)17-9-6-11(7-10-17)15(19)20/h3-4,11,21H,6-7,9-10H2,1-2H3,(H,19,20)InChIKey
OBENOXQFJZXHRI-UHFFFAOYSA-NSynonyms
1((5(3hydroxy3methylbut1yn1yl)thiophen2yl)carbonyl)piperidine4carboxylicacid
1((5(3HYDROXY3METHYLBUT1YNYL)2THIENYL)CARBONYL)PIPERIDINE4CARBOXYLICACID
1(5(3HYDROXY3METHYLBUT1YNYL)THIOPHENE2CARBONYL)PIPERIDINE4CARBOXYLICACID
CC(C)(C#CC1=CC=C(S1)C(=O)N2CCC(CC2)C(=O)O)O
InChI=1SC16H19NO4Sc116(221)85123413(2212)14(18)179611(71017)15(19)20h341121H67910H212H3(H1920)
MFCD05857166
ZINC000004418138
ZINC4418138
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