Vitas-M small molecule compound
3-[(2-chloro-4-fluorobenzyl)sulfanyl]-4-methyl-5-[4-(2-methylpropoxy)phenyl]-4H-1,2,4-triazole
Catalog ID
STK472714
SMILES CC(COc1ccc(cc1)c1nnc(n1C)SCc1ccc(cc1Cl)F)C
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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 C20H21ClFN3OS MW 405.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClFN3OS/c1-13(2)11-26-17-8-5-14(6-9-17)19-23-24-20(25(19)3)27-12-15-4-7-16(22)10-18(15)21/h4-10,13H,11-12H2,1-3H3InChIKey
VCDCEABCHDMFJW-UHFFFAOYSA-NSynonyms
1(5((2CHLORO4FLUOROPHENYL)METHYLTHIO)4METHYL(124TRIAZOL3YL))4(2METHYLPROPOXY)BENZENE
3((2chloro4fluorobenzyl)sulfanyl)4methyl5(4(2methylpropoxy)phenyl)4H124triazole
3((2chloro4fluorophenyl)methylsulfanyl)4methyl5(4(2methylpropoxy)phenyl)124triazole
CC(C)COC1=CC=C(C=C1)C2=NN=C(N2C)SCC3=C(C=C(C=C3)F)Cl
InChI=1SC20H21ClFN3OSc113(2)1126178514(6917)19232420(25(19)3)2712154716(22)1018(15)21h41013H1112H213H3
MFCD07077040
ZINC000017083287
ZINC17083287
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