Vitas-M small molecule compound
(5Z)-5-[3-methoxy-4-(prop-2-en-1-yloxy)benzylidene]-2-[(E)-2-(thiophen-2-yl)ethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK904525
SMILES C=CCOc1ccc(cc1OC)/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1cccs1
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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 C21H17N3O3S2 MW 423.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O3S2/c1-3-10-27-16-8-6-14(12-17(16)26-2)13-18-20(25)24-21(29-18)22-19(23-24)9-7-15-5-4-11-28-15/h3-9,11-13H,1,10H2,2H3/b9-7+,18-13-InChIKey
GOSNOJYUTSLHIS-DNISPXHZSA-NSynonyms
(5Z)5((3methoxy4prop2enoxyphenyl)methylidene)2((E)2thiophen2ylethenyl)(13)thiazolo(32b)(124)triazol6one
(5Z)5(3methoxy4(prop2en1yloxy)benzylidene)2((E)2(thiophen2yl)ethenyl)(13)thiazolo(32b)(124)triazol6(5H)one
C=CCOc1ccc(cc1OC)C=c1sc2n(c1=O)nc(n2)C=Cc1cccs1
COC1=C(C=CC(=C1)C=C2C(=O)N3C(=NC(=N3)C=CC4=CC=CS4)S2)OCC=C
InChI=1SC21H17N3O3S2c131027168614(1217(16)262)131820(25)2421(2918)2219(2324)971554112815h391113H110H22H3b97+1813
MFCD18076096
ZINC000027022108
ZINC27022108
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