Vitas-M small molecule compound

(5Z)-2-(3,4-dihydroisoquinolin-2(1H)-yl)-5-(4-methoxybenzylidene)-1,3-thiazol-4(5H)-one

Catalog ID
STK795259
SMILES COc1ccc(cc1)/C=C/1\SC(=NC1=O)N1CCc2c(C1)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 C20H18N2O2S MW 350.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O2S/c1-24-17-8-6-14(7-9-17)12-18-19(23)21-20(25-18)22-11-10-15-4-2-3-5-16(15)13-22/h2-9,12H,10-11,13H2,1H3/b18-12-
InChIKey
OPGZNFXYCJZVTR-PDGQHHTCSA-N
Synonyms
1164521-63-4
(5Z)2(34DIHYDRO1HISOQUINOLIN2YL)5((4METHOXYPHENYL)METHYLIDENE)13THIAZOL4ONE
(5Z)2(34dihydroisoquinolin2(1H)yl)5(4methoxybenzylidene)13thiazol4(5H)one
(Z)2(34dihydroisoquinolin2(1H)yl)5(4methoxybenzylidene)thiazol4(5H)one
1164521634
2(34DIHYDRO1HISOQUINOLIN2YL)5(1(4METHOXYPHENYL)METH(Z)YLIDENE)THIAZOL4ONE
COC1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CCC4=CC=CC=C4C3
COc1ccc(cc1)C=C1SC(=NC1=O)N1CCc2c(C1)cccc2
InChI=1SC20H18N2O2Sc124178614(7917)121819(23)2120(2518)22111015423516(15)1322h2912H101113H21H3b1812
MFCD03691607
ZINC000013496621
ZINC13496621

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Available files

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