Vitas-M small molecule compound
2-({4-amino-5-[3-(4-chlorophenyl)-1H-pyrazol-5-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4,6-trimethylphenyl)acetamide
Catalog ID
STL144849
SMILES O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1N)c1[nH]nc(c1)c1ccc(cc1)Cl
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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 C22H22ClN7OS MW 467.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN7OS/c1-12-8-13(2)20(14(3)9-12)25-19(31)11-32-22-29-28-21(30(22)24)18-10-17(26-27-18)15-4-6-16(23)7-5-15/h4-10H,11,24H2,1-3H3,(H,25,31)(H,26,27)InChIKey
ZWJBHMGJQWICJV-UHFFFAOYSA-NSynonyms
879446-84-12((4AMINO5(3(4CHLOROPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)N(246TRIMETHYLPHENYL)ACETAMIDE
2((4amino5(3(4chlorophenyl)1Hpyrazol5yl)4H124triazol3yl)sulfanyl)N(246trimethylphenyl)acetamide
2((4amino5(3(4chlorophenyl)1Hpyrazol5yl)4H124triazol3yl)thio)Nmesitylacetamide
2(4AMINO5(3(4CHLOROPHENYL)PYRAZOL5YL)(124TRIAZOL3YLTHIO))N(246TRIMETHYLPHENYL)ACETAMIDE
879446841
CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NN=C(N2N)C3=CC(=NN3)C4=CC=C(C=C4)Cl)C
InChI=1SC22H22ClN7OSc112813(2)20(14(3)912)2519(31)113222292821(30(22)24)181017(262718)154616(23)7515h410H1124H213H3(H2531)(H2627)
MFCD06774621
O=C(Nc1c(C)cc(cc1C)C)CSc1nnc(n1N)c1(nH)nc(c1)c1ccc(cc1)Cl
ZINC000009450914
ZINC09450914
ZINC9450914
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.