Vitas-M small molecule compound

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

Catalog ID
STK595135
SMILES O=C(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)F

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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 C21H14F7N7OS MW 545.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14F7N7OS/c22-13-3-1-10(2-4-13)15-8-16(32-31-15)18-33-34-19(35(18)29)37-9-17(36)30-14-6-11(20(23,24)25)5-12(7-14)21(26,27)28/h1-8H,9,29H2,(H,30,36)(H,31,32)
InChIKey
MEDHFWYVTWJDOX-UHFFFAOYSA-N
Synonyms
879463-91-9
2((4AMINO5(3(4FLUOROPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)N(35BIS(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2((4amino5(3(4fluorophenyl)1Hpyrazol5yl)4H124triazol3yl)thio)N(35bis(trifluoromethyl)phenyl)acetamide
2((4amino5(5(4fluorophenyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)N(35bis(trifluoromethyl)phenyl)acetamide
2(4AMINO5(3(4FLUOROPHENYL)PYRAZOL5YL)(124TRIAZOL3YLTHIO))N(35BIS(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
879463919
C1=CC(=CC=C1C2=NNC(=C2)C3=NN=C(N3N)SCC(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F)F
InChI=1SC21H14F7N7OSc22133110(2413)15816(323115)18333419(35(18)29)37917(36)3014611(20(2324)25)512(714)21(2627)28h18H929H2(H3036)(H3132)
MFCD07210050
O=C(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)CSc1nnc(n1N)c1(nH)nc(c1)c1ccc(cc1)F
O=C(Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)CSc1nnc(n1N)c1n(nH)c(c1)c1ccc(cc1)F
ZINC000097990111
ZINC97990111

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Available files

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