Vitas-M small molecule compound

3-phenyl-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-1,2,4-triazol-4-amine

Catalog ID
STL339425
SMILES Nn1c(SCc2cccc(c2)C(F)(F)F)nnc1c1ccccc1

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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 C16H13F3N4S MW 350.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13F3N4S/c17-16(18,19)13-8-4-5-11(9-13)10-24-15-22-21-14(23(15)20)12-6-2-1-3-7-12/h1-9H,10,20H2
InChIKey
FXTBCMRMMXRLON-UHFFFAOYSA-N
Synonyms
674788-29-5
3phenyl5((3(trifluoromethyl)benzyl)sulfanyl)4H124triazol4amine
3phenyl5((3(trifluoromethyl)benzyl)thio)4H124triazol4amine
3PHENYL5((3(TRIFLUOROMETHYL)PHENYL)METHYLSULFANYL)124TRIAZOL4AMINE
5PHENYL3((3(TRIFLUOROMETHYL)PHENYL)METHYLTHIO)124TRIAZOLE4YLAMINE
674788295
C1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC(=CC=C3)C(F)(F)F
InChI=1SC16H13F3N4Sc1716(1819)1384511(913)102415222114(23(15)20)126213712h19H1020H2
MFCD04011283
ZINC000001077490
ZINC01077490
ZINC1077490

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Available files

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