Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(4-methoxyphenyl)ethanone
Catalog ID
STL026155
SMILES COc1ccc(cc1)C(=O)CSc1nnc(n1c1ccccc1)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 C27H27N3O2S MW 457.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N3O2S/c1-27(2,3)21-14-10-20(11-15-21)25-28-29-26(30(25)22-8-6-5-7-9-22)33-18-24(31)19-12-16-23(32-4)17-13-19/h5-17H,18H2,1-4H3InChIKey
NAFYCEIURADSIM-UHFFFAOYSA-NSynonyms
428844-37-52((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)1(4methoxyphenyl)ethanone
2((5(4TERTBUTYLPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)1(4METHOXYPHENYL)ETHANONE
2((5(4TERTBUTYLPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)1(4METHOXYPHENYL)ETHAN1ONE
2((5(4tertbutylphenyl)4phenyl4H124triazol3yl)sulfanyl)1(4methoxyphenyl)ethanone
2(5(4(TERTBUTYL)PHENYL)4PHENYL(124TRIAZOL3YLTHIO))1(4METHOXYPHENYL)ETHAN1ONE
428844375
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)C4=CC=C(C=C4)OC
InChI=1SC27H27N3O2Sc127(23)21141020(111521)25282926(30(25)228657922)331824(31)19121623(324)171319h517H18H214H3
MFCD02921349
ZINC000009027359
ZINC09027359
ZINC9027359
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