Vitas-M small molecule compound
3-[(2-chlorobenzyl)sulfanyl]-5-[4-(cyclopentyloxy)phenyl]-4-methyl-4H-1,2,4-triazole
Catalog ID
STK484086
SMILES Cn1c(nnc1c1ccc(cc1)OC1CCCC1)SCc1ccccc1Cl
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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 C21H22ClN3OS MW 399.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN3OS/c1-25-20(15-10-12-18(13-11-15)26-17-7-3-4-8-17)23-24-21(25)27-14-16-6-2-5-9-19(16)22/h2,5-6,9-13,17H,3-4,7-8,14H2,1H3InChIKey
YIVJRRDHKAZVFP-UHFFFAOYSA-NSynonyms
1(5((2CHLOROPHENYL)METHYLTHIO)4METHYL(124TRIAZOL3YL))4CYCLOPENTYLOXYBENZENE
3((2chlorobenzyl)sulfanyl)5(4(cyclopentyloxy)phenyl)4methyl4H124triazole
3((2chlorophenyl)methylsulfanyl)5(4cyclopentyloxyphenyl)4methyl124triazole
CN1C(=NN=C1SCC2=CC=CC=C2Cl)C3=CC=C(C=C3)OC4CCCC4
InChI=1SC21H22ClN3OSc12520(15101218(131115)2617734817)232421(25)271416625919(16)22h25691317H347814H21H3
MFCD07125308
ZINC000013325478
ZINC13325478
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