Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxyphenyl)ethanone
Catalog ID
STL294022
SMILES COc1ccc(cc1)C(=O)CSc1nnc(n1C)c1ccc(cc1)C(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 C22H25N3O2S MW 395.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O2S/c1-22(2,3)17-10-6-16(7-11-17)20-23-24-21(25(20)4)28-14-19(26)15-8-12-18(27-5)13-9-15/h6-13H,14H2,1-5H3InChIKey
BXHCDAYXTNFLPJ-UHFFFAOYSA-NSynonyms
848987-59-72((5(4(tertbutyl)phenyl)4methyl4H124triazol3yl)thio)1(4methoxyphenyl)ethanone
2((5(4TERTBUTYLPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)1(4METHOXYPHENYL)ETHANONE
2((5(4TERTBUTYLPHENYL)4METHYL4H124TRIAZOL3YL)SULFANYL)1(4METHOXYPHENYL)ETHAN1ONE
2((5(4tertbutylphenyl)4methyl4H124triazol3yl)sulfanyl)1(4methoxyphenyl)ethanone
2(5(4(TERTBUTYL)PHENYL)4METHYL(124TRIAZOL3YLTHIO))1(4METHOXYPHENYL)ETHAN1ONE
848987597
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)C3=CC=C(C=C3)OC
InChI=1SC22H25N3O2Sc122(23)1710616(71117)20232421(25(20)4)281419(26)1581218(275)13915h613H14H215H3
MFCD05678620
ZINC000002446209
ZINC02446209
ZINC2446209
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