Vitas-M small molecule compound

4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-oxobutanoic acid

Catalog ID
STK174666
SMILES OC(=O)CCC(=O)N1CCC(CC1)c1nc2c(s1)cccc2

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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 C16H18N2O3S MW 318.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O3S/c19-14(5-6-15(20)21)18-9-7-11(8-10-18)16-17-12-3-1-2-4-13(12)22-16/h1-4,11H,5-10H2,(H,20,21)
InChIKey
QFXBRTRUIPJKDK-UHFFFAOYSA-N
Synonyms

4(4(13BENZOTHIAZOL2YL)PIPERIDIN1YL)4OXOBUTANOICACID
C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CCC(=O)O
InChI=1SC16H18N2O3Sc1914(5615(20)21)189711(81018)161712312413(12)2216h1411H510H2(H2021)
MFCD05858860
ZINC000001443506
ZINC1443506

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.