Vitas-M small molecule compound

ethyl 1-[(5Z)-5-(4-methylbenzylidene)-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperidine-3-carboxylate

Catalog ID
STK005865
SMILES CCOC(=O)C1CCCN(C1)C1=NC(=O)/C(=C/c2ccc(cc2)C)/S1

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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 C19H22N2O3S MW 358.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O3S/c1-3-24-18(23)15-5-4-10-21(12-15)19-20-17(22)16(25-19)11-14-8-6-13(2)7-9-14/h6-9,11,15H,3-5,10,12H2,1-2H3/b16-11-
InChIKey
DBLRSAGQHQXUCY-WJDWOHSUSA-N
Synonyms

CCOC(=O)C1CCCN(C1)C1=NC(=O)C(=Cc2ccc(cc2)C)S1
CCOC(=O)C1CCCN(C1)C2=NC(=O)C(=CC3=CC=C(C=C3)C)S2
ETHYL1((5Z)5((4METHYLPHENYL)METHYLIDENE)4OXO13THIAZOL2YL)PIPERIDINE3CARBOXYLATE
ETHYL1((5Z)5(4METHYLBENZYLIDENE)4OXO45DIHYDRO13THIAZOL2YL)PIPERIDINE3CARBOXYLATE
InChI=1SC19H22N2O3Sc132418(23)15541021(1215)192017(22)16(2519)11148613(2)7914h691115H351012H212H3b1611
MFCD08049190
STK005865
ZINC000004550372
ZINC000004550373

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Available files

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