Vitas-M small molecule compound
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-[(4-fluorobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazole
Catalog ID
STK257183
SMILES Fc1ccc(cc1)CSc1nnc(n1C)c1ccc2c(c1)OCCO2
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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 C18H16FN3O2S MW 357.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16FN3O2S/c1-22-17(13-4-7-15-16(10-13)24-9-8-23-15)20-21-18(22)25-11-12-2-5-14(19)6-3-12/h2-7,10H,8-9,11H2,1H3InChIKey
LFIVYMVBNFNLOI-UHFFFAOYSA-NSynonyms
3(23DIHYDRO14BENZODIOXIN6YL)5((4FLUOROBENZYL)SULFANYL)4METHYL4H124TRIAZOLE
3(23dihydro14benzodioxin6yl)5((4fluorophenyl)methylsulfanyl)4methyl124triazole
CN1C(=NN=C1SCC2=CC=C(C=C2)F)C3=CC4=C(C=C3)OCCO4
InChI=1SC18H16FN3O2Sc12217(13471516(1013)24982315)202118(22)2511122514(19)6312h2710H8911H21H3
MFCD08672384
ZINC000009356043
ZINC09356043
ZINC9356043
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