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2-({4-amino-5-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-chloro-2-(trifluoromethyl)phenyl]acetamide

Catalog ID
STK583605
SMILES O=C(Nc1ccc(cc1C(F)(F)F)Cl)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)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 C21H17ClF3N7OS MW 507.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClF3N7OS/c1-11-2-4-12(5-3-11)16-9-17(29-28-16)19-30-31-20(32(19)26)34-10-18(33)27-15-7-6-13(22)8-14(15)21(23,24)25/h2-9H,10,26H2,1H3,(H,27,33)(H,28,29)
InChIKey
LRGDRPTYASZCDK-UHFFFAOYSA-N
Synonyms
879431-75-1
2((4AMINO5(3(4METHYLPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)N(4CHLORO2(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2((4amino5(3(ptolyl)1Hpyrazol5yl)4H124triazol3yl)thio)N(4chloro2(trifluoromethyl)phenyl)acetamide
2((4amino5(5(4methylphenyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)N(4chloro2(trifluoromethyl)phenyl)acetamide
2(4AMINO5(3(4METHYLPHENYL)PYRAZOL5YL)(124TRIAZOL3YLTHIO))N(4CHLORO2(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
879431751
CC1=CC=C(C=C1)C2=NNC(=C2)C3=NN=C(N3N)SCC(=O)NC4=C(C=C(C=C4)Cl)C(F)(F)F
InChI=1SC21H17ClF3N7OSc1112412(5311)16917(292816)19303120(32(19)26)341018(33)27157613(22)814(15)21(2324)25h29H1026H21H3(H2733)(H2829)
MFCD07199351
O=C(Nc1ccc(cc1C(F)(F)F)Cl)CSc1nnc(n1N)c1(nH)nc(c1)c1ccc(cc1)C
O=C(Nc1ccc(cc1C(F)(F)F)Cl)CSc1nnc(n1N)c1n(nH)c(c1)c1ccc(cc1)C
ZINC000009449330
ZINC09449330
ZINC9449330

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Available files

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