Vitas-M small molecule compound
3-{[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]sulfanyl}-5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazole
Catalog ID
STK132048
SMILES Clc1cc(CSc2nnc(n2c2ccccc2)c2cccc(c2)F)c2c(c1)COCO2
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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 C23H17ClFN3O2S MW 453.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClFN3O2S/c24-18-9-16-12-29-14-30-21(16)17(10-18)13-31-23-27-26-22(15-5-4-6-19(25)11-15)28(23)20-7-2-1-3-8-20/h1-11H,12-14H2InChIKey
ZVJCKMXLKGXNDG-UHFFFAOYSA-NSynonyms
(6CHLORO4H13BENZODIOXIN8YL)METHYL5(3FLUOROPHENYL)4PHENYL4H124TRIAZOL3YLSULFIDE
3(((6CHLORO4H13BENZODIOXIN8YL)METHYL)SULFANYL)5(3FLUOROPHENYL)4PHENYL4H124TRIAZOLE
3((6CHLORO4H13BENZODIOXIN8YL)METHYLSULFANYL)5(3FLUOROPHENYL)4PHENYL124TRIAZOLE
C1C2=CC(=CC(=C2OCO1)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC(=CC=C5)F)Cl
InChI=1SC23H17ClFN3O2Sc24189161229143021(16)17(1018)133123272622(1554619(25)1115)28(23)207213820h111H1214H2
MFCD03196999
ZINC000002170964
ZINC02170964
ZINC2170964
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