Vitas-M small molecule compound

3-[(4-chlorophenoxy)methyl]-5-[(3-fluorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazole

Catalog ID
STL042036
SMILES COc1ccc(cc1)n1c(nnc1SCc1cccc(c1)F)COc1ccc(cc1)Cl

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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 C23H19ClFN3O2S MW 455.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClFN3O2S/c1-29-20-11-7-19(8-12-20)28-22(14-30-21-9-5-17(24)6-10-21)26-27-23(28)31-15-16-3-2-4-18(25)13-16/h2-13H,14-15H2,1H3
InChIKey
PHFYIOSCMBDBEU-UHFFFAOYSA-N
Synonyms
861116-82-7
3((4chlorophenoxy)methyl)5((3fluorobenzyl)sulfanyl)4(4methoxyphenyl)4H124triazole
3((4chlorophenoxy)methyl)5((3fluorobenzyl)thio)4(4methoxyphenyl)4H124triazole
3((4CHLOROPHENOXY)METHYL)5((3FLUOROPHENYL)METHYLSULFANYL)4(4METHOXYPHENYL)124TRIAZOLE
3(4CHLOROPHENOXYMETHYL)5(((3FLUOROPHENYL)METHYL)SULFANYL)4(4METHOXYPHENYL)4H124TRIAZOLE
4CHLORO1((5((3FLUOROPHENYL)METHYLTHIO)4(4METHOXYPHENYL)(124TRIAZOL3YL))METHOXY)BENZENE
861116827
COC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)F)COC4=CC=C(C=C4)Cl
InChI=1SC23H19ClFN3O2Sc1292011719(81220)2822(1430219517(24)61021)262723(28)31151632418(25)1316h213H1415H21H3
MFCD05682966
ZINC000009307529
ZINC09307529
ZINC9307529

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Available files

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