Vitas-M small molecule compound
(5Z)-5-(2,4-dimethoxybenzylidene)-2-[(E)-2-(4-fluorophenyl)ethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK906710
SMILES COc1cc(OC)ccc1/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccc(cc1)F
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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 C21H16FN3O3S MW 409.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16FN3O3S/c1-27-16-9-6-14(17(12-16)28-2)11-18-20(26)25-21(29-18)23-19(24-25)10-5-13-3-7-15(22)8-4-13/h3-12H,1-2H3/b10-5+,18-11-InChIKey
WXUGOGZVJIDZSA-HNBDTFNUSA-NSynonyms
845902-66-1(5Z)5((24DIMETHOXYPHENYL)METHYLIDENE)2((E)2(4FLUOROPHENYL)ETHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(24dimethoxybenzylidene)2((E)2(4fluorophenyl)ethenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)5(24dimethoxybenzylidene)2((E)4fluorostyryl)thiazolo(32b)(124)triazol6(5H)one
845902661
COC1=CC(=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C=CC4=CC=C(C=C4)F)S2)OC
COc1cc(OC)ccc1C=c1sc2n(c1=O)nc(n2)C=Cc1ccc(cc1)F
InChI=1SC21H16FN3O3Sc127169614(17(1216)282)111820(26)2521(2918)2319(2425)105133715(22)8413h312H12H3b105+1811
MFCD04173175
ZINC000005192716
ZINC05192716
ZINC5192716
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