Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Catalog ID
STL294012
SMILES O=C(Nc1cc(ccc1Cl)C(F)(F)F)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 C22H22ClF3N4OS MW 482.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClF3N4OS/c1-21(2,3)14-7-5-13(6-8-14)19-28-29-20(30(19)4)32-12-18(31)27-17-11-15(22(24,25)26)9-10-16(17)23/h5-11H,12H2,1-4H3,(H,27,31)InChIKey
FQJJGRRWZDYKJT-UHFFFAOYSA-NSynonyms
848989-39-92((5(4(tertbutyl)phenyl)4methyl4H124triazol3yl)thio)N(2chloro5(trifluoromethyl)phenyl)acetamide
2((5(4TERTBUTYLPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2((5(4tertbutylphenyl)4methyl4H124triazol3yl)sulfanyl)N(2chloro5(trifluoromethyl)phenyl)acetamide
848989399
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl
InChI=1SC22H22ClF3N4OSc121(23)147513(6814)19282920(30(19)4)321218(31)27171115(22(2425)26)91016(17)23h511H12H214H3(H2731)
MFCD05533196
ZINC000002446537
ZINC02446537
ZINC2446537
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