Vitas-M small molecule compound
3-{[(6-chloro-1,3-benzodioxol-5-yl)methyl]sulfanyl}-5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazole
Catalog ID
STK767678
SMILES Fc1cccc(c1)c1nnc(n1c1ccccc1)SCc1cc2OCOc2cc1Cl
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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 C22H15ClFN3O2S MW 439.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClFN3O2S/c23-18-11-20-19(28-13-29-20)10-15(18)12-30-22-26-25-21(14-5-4-6-16(24)9-14)27(22)17-7-2-1-3-8-17/h1-11H,12-13H2InChIKey
PINLUNBGGIAWDA-UHFFFAOYSA-NSynonyms
3(((6chloro13benzodioxol5yl)methyl)sulfanyl)5(3fluorophenyl)4phenyl4H124triazole
3((6CHLORO13BENZODIOXOL5YL)METHYLSULFANYL)5(3FLUOROPHENYL)4PHENYL124TRIAZOLE
C1OC2=C(O1)C=C(C(=C2)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC(=CC=C5)F)Cl
InChI=1SC22H15ClFN3O2Sc2318112019(28132920)1015(18)123022262521(1454616(24)914)27(22)177213817h111H1213H2
MFCD03034920
ZINC000002191932
ZINC02191932
ZINC2191932
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