Vitas-M small molecule compound

4-[2-chloro-5-(trifluoromethyl)phenyl]-5-[(1R,2R)-2-phenylcyclopropyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK846105
SMILES S=c1[nH]nc(n1c1cc(ccc1Cl)C(F)(F)F)[C@@H]1C[C@H]1c1ccccc1

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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 C18H13ClF3N3S MW 395.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13ClF3N3S/c19-14-7-6-11(18(20,21)22)8-15(14)25-16(23-24-17(25)26)13-9-12(13)10-4-2-1-3-5-10/h1-8,12-13H,9H2,(H,24,26)/t12-,13+/m0/s1
InChIKey
ZYUXKGDCCODIMB-QWHCGFSZSA-N
Synonyms
1087758-41-5
1087758415
MFCD18247022
S=c1(nH)nc(n1c1cc(ccc1Cl)C(F)(F)F)(C@@H)1C(C@H)1c1ccccc1
ZINC000005593947

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.