Vitas-M small molecule compound
2-({5-[(4-tert-butylphenoxy)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(3-methylphenyl)acetamide
Catalog ID
STK680485
SMILES Cc1cccc(c1)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/c1-20-8-6-10-23(16-20)30-27(34)19-36-28-32-31-26(33(28)24-11-7-9-21(2)17-24)18-35-25-14-12-22(13-15-25)29(3,4)5/h6-17H,18-19H2,1-5H3,(H,30,34)InChIKey
SBQXSUVIVQISQD-UHFFFAOYSA-NSynonyms
2((5((4TERTBUTYLPHENOXY)METHYL)4(3METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(3METHYLPHENYL)ACETAMIDE
2((5((4tertbutylphenoxy)methyl)4(3methylphenyl)4H124triazol3yl)sulfanyl)N(3methylphenyl)acetamide
CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC(=C3)C)COC4=CC=C(C=C4)C(C)(C)C
InChI=1SC29H32N4O2Sc120861023(1620)3027(34)193628323126(33(28)24117921(2)1724)183525141222(131525)29(34)5h617H1819H215H3(H3034)
MFCD03459802
ZINC000002684249
ZINC02684249
ZINC2684249
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