Vitas-M small molecule compound
2-({5-[(4-tert-butylphenoxy)methyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide
Catalog ID
STL186075
SMILES Cc1ccc(cc1)n1c(COc2ccc(cc2)C(C)(C)C)nnc1SCC(=O)Nc1cccc(c1)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 C29H32N4O2S MW 500.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O2S/c1-20-9-13-24(14-10-20)33-26(18-35-25-15-11-22(12-16-25)29(3,4)5)31-32-28(33)36-19-27(34)30-23-8-6-7-21(2)17-23/h6-17H,18-19H2,1-5H3,(H,30,34)InChIKey
HNAHEEOLCIQWGR-UHFFFAOYSA-NSynonyms
2((5((4tertbutylphenoxy)methyl)4(4methylphenyl)124triazol3yl)sulfanyl)N(3methylphenyl)acetamide2((5((4tertbutylphenoxy)methyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)N(3methylphenyl)acetamide
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=CC(=C3)C)COC4=CC=C(C=C4)C(C)(C)C
Registry IDs
MFCD03460019ZINC000027525315
ZINC27525315
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