Vitas-M small molecule compound
4-phenyl-5-[3-(trifluoromethyl)benzyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK663567
SMILES Sc1nnc(n1c1ccccc1)Cc1cccc(c1)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 C16H12F3N3S MW 335.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12F3N3S/c17-16(18,19)12-6-4-5-11(9-12)10-14-20-21-15(23)22(14)13-7-2-1-3-8-13/h1-9H,10H2,(H,21,23)InChIKey
AYAYMNNHDDTQDQ-UHFFFAOYSA-NSynonyms
4PHENYL3((3(TRIFLUOROMETHYL)PHENYL)METHYL)1H124TRIAZOLE5THIONE
4PHENYL5((3(TRIFLUOROMETHYL)PHENYL)METHYL)124TRIAZOLE3THIOL
4phenyl5(3(trifluoromethyl)benzyl)4H124triazole3thiol
C1=CC=C(C=C1)N2C(=NNC2=S)CC3=CC(=CC=C3)C(F)(F)F
InChI=1SC16H12F3N3Sc1716(1819)1264511(912)1014202115(23)22(14)137213813h19H10H2(H2123)
MFCD01899677
ZINC000005687920
ZINC5687920
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