Vitas-M small molecule compound
4-(4-chlorobenzyl)-5-{[(2-chloro-4-fluorobenzyl)sulfanyl]methyl}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK445767
SMILES Clc1ccc(cc1)Cn1c(CSCc2ccc(cc2Cl)F)nnc1S
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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 C17H14Cl2FN3S2 MW 414.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14Cl2FN3S2/c18-13-4-1-11(2-5-13)8-23-16(21-22-17(23)24)10-25-9-12-3-6-14(20)7-15(12)19/h1-7H,8-10H2,(H,22,24)InChIKey
MPYHDCSVWYUUIF-UHFFFAOYSA-NSynonyms
3((2chloro4fluorophenyl)methylsulfanylmethyl)4((4chlorophenyl)methyl)1H124triazole5thione
4(4chlorobenzyl)5(((2chloro4fluorobenzyl)sulfanyl)methyl)4H124triazole3thiol
5(((2CHLORO4FLUOROPHENYL)METHYLTHIO)METHYL)4((4CHLOROPHENYL)METHYL)124TRIAZOLE3THIOL
C1=CC(=CC=C1CN2C(=NNC2=S)CSCC3=C(C=C(C=C3)F)Cl)Cl
InChI=1SC17H14Cl2FN3S2c18134111(2513)82316(212217(23)24)10259123614(20)715(12)19h17H810H2(H2224)
MFCD04058442
ZINC000017089779
ZINC17089779
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