Vitas-M small molecule compound

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

Catalog ID
STK078947
SMILES CCOC(=O)C1CCN(CC1)C1=NC(=O)/C(=C/c2ccc(cc2)Cl)/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 C18H19ClN2O3S MW 378.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN2O3S/c1-2-24-17(23)13-7-9-21(10-8-13)18-20-16(22)15(25-18)11-12-3-5-14(19)6-4-12/h3-6,11,13H,2,7-10H2,1H3/b15-11-
InChIKey
RXMROHIUYOJRSX-PTNGSMBKSA-N
Synonyms
385421-51-2
(Z)ethyl1(5(4chlorobenzylidene)4oxo45dihydrothiazol2yl)piperidine4carboxylate
385421512
CCOC(=O)C1CCN(CC1)C1=NC(=O)C(=Cc2ccc(cc2)Cl)S1
CCOC(=O)C1CCN(CC1)C2=NC(=O)C(=CC3=CC=C(C=C3)Cl)S2
ETHYL1((5Z)5((4CHLOROPHENYL)METHYLIDENE)4OXO13THIAZOL2YL)PIPERIDINE4CARBOXYLATE
ETHYL1((5Z)5(4CHLOROBENZYLIDENE)4OXO45DIHYDRO13THIAZOL2YL)PIPERIDINE4CARBOXYLATE
InChI=1SC18H19ClN2O3Sc122417(23)137921(10813)182016(22)15(2518)11123514(19)6412h361113H2710H21H3b1511
MFCD03033447
STK078947
ZINC000001438668
ZINC01438668
ZINC1438668

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Available files

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