Vitas-M small molecule compound

4-{5-[(2-chloro-6-fluorobenzyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}pyridine

Catalog ID
STK046883
SMILES Cc1ccc(cc1)n1c(SCc2c(F)cccc2Cl)nnc1c1ccncc1

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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 C21H16ClFN4S MW 410.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClFN4S/c1-14-5-7-16(8-6-14)27-20(15-9-11-24-12-10-15)25-26-21(27)28-13-17-18(22)3-2-4-19(17)23/h2-12H,13H2,1H3
InChIKey
LGGXNCORWLZRPH-UHFFFAOYSA-N
Synonyms
443741-50-2
3((6CHLORO2FLUOROPHENYL)METHYLTHIO)4(4METHYLPHENYL)5(4PYRIDYL)124TRIAZOLE
4(5(((2CHLORO6FLUOROPHENYL)METHYL)SULFANYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)PYRIDINE
4(5((2CHLORO6FLUOROBENZYL)SULFANYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)PYRIDINE
4(5((2chloro6fluorobenzyl)thio)4(ptolyl)4H124triazol3yl)pyridine
4(5((2CHLORO6FLUOROPHENYL)METHYLSULFANYL)4(4METHYLPHENYL)124TRIAZOL3YL)PYRIDINE
443741502
CC1=CC=C(C=C1)N2C(=NN=C2SCC3=C(C=CC=C3Cl)F)C4=CC=NC=C4
Cc1ccc(cc1)n1c(SCc2c(F)cccc2Cl)nnc1c1ccncc1
InChI=1SC21H16ClFN4Sc1145716(8614)2720(1591124121015)252621(27)28131718(22)32419(17)23h212H13H21H3
MFCD02226721
STK046883
ZINC000000897318
ZINC00897318
ZINC897318

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.