Vitas-M small molecule compound

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

Catalog ID
STK085591
SMILES COc1ccc(cc1)c1nnc(n1CC)SCC(=O)Nc1cc(ccc1Cl)C(F)(F)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 C20H18ClF3N4O2S MW 470.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClF3N4O2S/c1-3-28-18(12-4-7-14(30-2)8-5-12)26-27-19(28)31-11-17(29)25-16-10-13(20(22,23)24)6-9-15(16)21/h4-10H,3,11H2,1-2H3,(H,25,29)
InChIKey
CRPNUPPEXVSOLG-UHFFFAOYSA-N
Synonyms
532945-20-3
532945203
CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)C3=CC=C(C=C3)OC
COc1ccc(cc1)c1nnc(n1CC)SCC(=O)Nc1cc(ccc1Cl)C(F)(F)F
InChI=1SC20H18ClF3N4O2Sc132818(124714(302)8512)262719(28)311117(29)25161013(20(2223)24)6915(16)21h410H311H212H3(H2529)
MFCD03571196
N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)2((4ETHYL5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)2((4ETHYL5(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2chloro5(trifluoromethyl)phenyl)2((4ethyl5(4methoxyphenyl)4H124triazol3yl)thio)acetamide
STK085591
ZINC000001132964
ZINC01132964
ZINC1132964

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Available files

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