Vitas-M small molecule compound
3-({[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-[(2-chloro-5-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole
Catalog ID
STK465199
SMILES Cc1ccc(c(c1)OCc1nnc(n1C)SCc1csc(n1)c1ccc2c(c1)OCO2)Cl
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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 C22H19ClN4O3S2 MW 487.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O3S2/c1-13-3-5-16(23)18(7-13)28-9-20-25-26-22(27(20)2)32-11-15-10-31-21(24-15)14-4-6-17-19(8-14)30-12-29-17/h3-8,10H,9,11-12H2,1-2H3InChIKey
DVOSAFVYKJDIGU-UHFFFAOYSA-NSynonyms
2((5((2(2HBENZO(34D)13DIOXOLAN5YL)(13THIAZOL4YL))METHYLTHIO)4METHYL(124TRIAZOL3YL))METHOXY)1CHLORO4METHYLBENZENE
2(13benzodioxol5yl)4((5((2chloro5methylphenoxy)methyl)4methyl124triazol3yl)sulfanylmethyl)13thiazole
3(((2(13benzodioxol5yl)13thiazol4yl)methyl)sulfanyl)5((2chloro5methylphenoxy)methyl)4methyl4H124triazole
CC1=CC(=C(C=C1)Cl)OCC2=NN=C(N2C)SCC3=CSC(=N3)C4=CC5=C(C=C4)OCO5
InChI=1SC22H19ClN4O3S2c1133516(23)18(713)28920252622(27(20)2)321115103121(2415)14461719(814)30122917h3810H91112H212H3
MFCD06141935
ZINC000020357293
ZINC20357293
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