Vitas-M small molecule compound
3-({[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5-[(4-chloro-3-methylphenoxy)methyl]-4-methyl-4H-1,2,4-triazole
Catalog ID
STK465196
SMILES Cc1cc(ccc1Cl)OCc1nnc(n1C)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 C22H19ClN4O3S2 MW 487.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O3S2/c1-13-7-16(4-5-17(13)23)28-9-20-25-26-22(27(20)2)32-11-15-10-31-21(24-15)14-3-6-18-19(8-14)30-12-29-18/h3-8,10H,9,11-12H2,1-2H3InChIKey
PCHFCDPFNZZTPP-UHFFFAOYSA-NSynonyms
2(13benzodioxol5yl)4((5((4chloro3methylphenoxy)methyl)4methyl124triazol3yl)sulfanylmethyl)13thiazole
3(((2(13benzodioxol5yl)13thiazol4yl)methyl)sulfanyl)5((4chloro3methylphenoxy)methyl)4methyl4H124triazole
4((5((2(2HBENZO(34D)13DIOXOLAN5YL)(13THIAZOL4YL))METHYLTHIO)4METHYL(124TRIAZOL3YL))METHOXY)1CHLORO2METHYLBENZENE
CC1=C(C=CC(=C1)OCC2=NN=C(N2C)SCC3=CSC(=N3)C4=CC5=C(C=C4)OCO5)Cl
InChI=1SC22H19ClN4O3S2c113716(4517(13)23)28920252622(27(20)2)321115103121(2415)14361819(814)30122918h3810H91112H212H3
MFCD06073939
ZINC000020352461
ZINC20352461
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