Vitas-M small molecule compound
3-({[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-[(4-methoxyphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Catalog ID
STK465448
SMILES C=CCn1c(nnc1COc1ccc(cc1)OC)SCc1csc(n1)c1ccc2c(c1)OCO2
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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 C24H22N4O4S2 MW 494.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O4S2/c1-3-10-28-22(12-30-19-7-5-18(29-2)6-8-19)26-27-24(28)34-14-17-13-33-23(25-17)16-4-9-20-21(11-16)32-15-31-20/h3-9,11,13H,1,10,12,14-15H2,2H3InChIKey
BNYQLFHZFSLLHT-UHFFFAOYSA-NSynonyms
1((5((2(2HBENZO(34D)13DIOXOLAN5YL)(13THIAZOL4YL))METHYLTHIO)4PROP2ENYL(124TRIAZOL3YL))METHOXY)4METHOXYBENZENE
2(13benzodioxol5yl)4((5((4methoxyphenoxy)methyl)4prop2enyl124triazol3yl)sulfanylmethyl)13thiazole
3(((2(13benzodioxol5yl)13thiazol4yl)methyl)sulfanyl)5((4methoxyphenoxy)methyl)4(prop2en1yl)4H124triazole
COC1=CC=C(C=C1)OCC2=NN=C(N2CC=C)SCC3=CSC(=N3)C4=CC5=C(C=C4)OCO5
InChI=1SC24H22N4O4S2c13102822(1230197518(292)6819)262724(28)341417133323(2517)16492021(1116)32153120h391113H110121415H22H3
MFCD06755987
ZINC000020249570
ZINC20249570
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