Vitas-M small molecule compound
4-(3-methoxyphenyl)-5-(3-{[4-(propan-2-yl)phenoxy]methyl}phenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK307460
SMILES COc1cccc(c1)n1c(S)nnc1c1cccc(c1)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 C25H25N3O2S MW 431.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O2S/c1-17(2)19-10-12-22(13-11-19)30-16-18-6-4-7-20(14-18)24-26-27-25(31)28(24)21-8-5-9-23(15-21)29-3/h4-15,17H,16H2,1-3H3,(H,27,31)InChIKey
XIVFIZVKDFQJPD-UHFFFAOYSA-NSynonyms
828292-35-94(3METHOXYPHENYL)3(3((4PROPAN2YLPHENOXY)METHYL)PHENYL)1H124TRIAZOLE5THIONE
4(3methoxyphenyl)5(3((4(propan2yl)phenoxy)methyl)phenyl)4H124triazole3thiol
828292359
CC(C)C1=CC=C(C=C1)OCC2=CC=CC(=C2)C3=NNC(=S)N3C4=CC(=CC=C4)OC
InChI=1SC25H25N3O2Sc117(2)19101222(131119)30161864720(1418)24262725(31)28(24)2185923(1521)293h41517H16H213H3(H2731)
MFCD04056725
ZINC000002793687
ZINC2793687
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