Vitas-M small molecule compound
3-[(3-methoxybenzyl)sulfanyl]-5-{[4-(propan-2-yl)phenoxy]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Catalog ID
STK454523
SMILES C=CCn1c(nnc1SCc1cccc(c1)OC)COc1ccc(cc1)C(C)C
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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 C23H27N3O2S MW 409.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O2S/c1-5-13-26-22(15-28-20-11-9-19(10-12-20)17(2)3)24-25-23(26)29-16-18-7-6-8-21(14-18)27-4/h5-12,14,17H,1,13,15-16H2,2-4H3InChIKey
NCMWMJHBINUJLE-UHFFFAOYSA-NSynonyms
1METHOXY3((5((4(METHYLETHYL)PHENOXY)METHYL)4PROP2ENYL(124TRIAZOL3YLTHIO))METHYL)BENZENE
3((3methoxybenzyl)sulfanyl)5((4(propan2yl)phenoxy)methyl)4(prop2en1yl)4H124triazole
3((3methoxyphenyl)methylsulfanyl)5((4propan2ylphenoxy)methyl)4prop2enyl124triazole
CC(C)C1=CC=C(C=C1)OCC2=NN=C(N2CC=C)SCC3=CC(=CC=C3)OC
InChI=1SC23H27N3O2Sc15132622(15282011919(101220)17(2)3)242523(26)29161876821(1418)274h5121417H1131516H224H3
MFCD04226835
ZINC000006828777
ZINC06828777
ZINC6828777
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