Vitas-M small molecule compound

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

Catalog ID
STK877630
SMILES CCOc1ccc(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 C21H20N2O2S MW 364.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O2S/c1-2-25-18-9-7-15(8-10-18)13-19-20(24)22-21(26-19)23-12-11-16-5-3-4-6-17(16)14-23/h3-10,13H,2,11-12,14H2,1H3/b19-13-
InChIKey
GFWYSMNJYTWKSW-UYRXBGFRSA-N
Synonyms
1164466-12-9
(5Z)2(34DIHYDRO1HISOQUINOLIN2YL)5((4ETHOXYPHENYL)METHYLIDENE)13THIAZOL4ONE
(5Z)2(34DIHYDRO1HISOQUINOLIN2YL)5((4ETHOXYPHENYL)METHYLIDENE)4THIAZOLONE
(5Z)2(34DIHYDRO1HISOQUINOLIN2YL)5(4ETHOXYBENZYLIDENE)2THIAZOLIN4ONE
(5Z)2(34dihydroisoquinolin2(1H)yl)5(4ethoxybenzylidene)13thiazol4(5H)one
(Z)2(34dihydroisoquinolin2(1H)yl)5(4ethoxybenzylidene)thiazol4(5H)one
1164466129
2(34DIHYDRO1HISOQUINOLIN2YL)5(1(4ETHOXYPHENYL)METH(Z)YLIDENE)THIAZOL4ONE
CCOC1=CC=C(C=C1)C=C2C(=O)N=C(S2)N3CCC4=CC=CC=C4C3
CCOc1ccc(cc1)C=C1SC(=NC1=O)N1CCc2c(C1)cccc2
InChI=1SC21H20N2O2Sc1225189715(81018)131920(24)2221(2619)23121116534617(16)1423h31013H2111214H21H3b1913
MFCD03686573
ZINC000013496622
ZINC13496622

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Available files

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