Vitas-M small molecule compound

(2E)-N-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-[4-methoxy-3-(piperidin-1-ylsulfonyl)phenyl]prop-2-enamide

Catalog ID
STK806723
SMILES COc1ccc(cc1S(=O)(=O)N1CCCCC1)/C=C/C(=O)Nc1scc(n1)c1ccc(cc1)OC

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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 C25H27N3O5S2 MW 513.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O5S2/c1-32-20-10-8-19(9-11-20)21-17-34-25(26-21)27-24(29)13-7-18-6-12-22(33-2)23(16-18)35(30,31)28-14-4-3-5-15-28/h6-13,16-17H,3-5,14-15H2,1-2H3,(H,26,27,29)/b13-7+
InChIKey
YRCQOIOCPYTFJR-NTUHNPAUSA-N
Synonyms

(2E)N(4(4METHOXYPHENYL)(13THIAZOL2YL))3(4METHOXY3(PIPERIDYLSULFONYL)PHENYL)PROP2ENAMIDE
(2E)N(4(4methoxyphenyl)13thiazol2yl)3(4methoxy3(piperidin1ylsulfonyl)phenyl)prop2enamide
(E)3(4methoxy3(piperidin1ylsulfonyl)phenyl)N(4(4methoxyphenyl)thiazol2yl)acrylamide
(E)N(4(4METHOXYPHENYL)13THIAZOL2YL)3(4METHOXY3PIPERIDIN1YLSULFONYLPHENYL)PROP2ENAMIDE
COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C=CC3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCCC4
COc1ccc(cc1S(=O)(=O)N1CCCCC1)C=CC(=O)Nc1scc(n1)c1ccc(cc1)OC
InChI=1SC25H27N3O5S2c1322010819(91120)21173425(2621)2724(29)1371861222(332)23(1618)35(3031)28144351528h6131617H351415H212H3(H262729)b137+
MFCD01829918
ZINC000009168248
ZINC09168248
ZINC9168248

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Available files

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