Vitas-M small molecule compound
5-{[(2-chloro-4-fluorobenzyl)sulfanyl]methyl}-4-(3,5-dimethylphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK445781
SMILES Fc1ccc(c(c1)Cl)CSCc1nnc(n1c1cc(C)cc(c1)C)S
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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 C18H17ClFN3S2 MW 393.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClFN3S2/c1-11-5-12(2)7-15(6-11)23-17(21-22-18(23)24)10-25-9-13-3-4-14(20)8-16(13)19/h3-8H,9-10H2,1-2H3,(H,22,24)InChIKey
MZYBRECXCLLDBE-UHFFFAOYSA-NSynonyms
3((2chloro4fluorophenyl)methylsulfanylmethyl)4(35dimethylphenyl)1H124triazole5thione
4(35DIMETHYLPHENYL)5(((2CHLORO4FLUOROPHENYL)METHYLTHIO)METHYL)124TRIAZOLE3THIOL
5(((2chloro4fluorobenzyl)sulfanyl)methyl)4(35dimethylphenyl)4H124triazole3thiol
CC1=CC(=CC(=C1)N2C(=NNC2=S)CSCC3=C(C=C(C=C3)F)Cl)C
InChI=1SC18H17ClFN3S2c111512(2)715(611)2317(212218(23)24)10259133414(20)816(13)19h38H910H212H3(H2224)
MFCD04058238
ZINC000006527788
ZINC06527788
ZINC6527788
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