Vitas-M small molecule compound
5-{[(6-bromonaphthalen-2-yl)oxy]methyl}-4-[3-(morpholin-4-yl)propyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK306321
SMILES Brc1ccc2c(c1)ccc(c2)OCc1nnc(n1CCCN1CCOCC1)S
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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 C20H23BrN4O2S MW 463.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23BrN4O2S/c21-17-4-2-16-13-18(5-3-15(16)12-17)27-14-19-22-23-20(28)25(19)7-1-6-24-8-10-26-11-9-24/h2-5,12-13H,1,6-11,14H2,(H,23,28)InChIKey
HLLPCAURYATUPA-UHFFFAOYSA-NSynonyms
828278-10-03((6BROMONAPHTHALEN2YL)OXYMETHYL)4(3MORPHOLIN4YLPROPYL)1H124TRIAZOLE5THIONE
5(((6bromonaphthalen2yl)oxy)methyl)4(3(morpholin4yl)propyl)4H124triazole3thiol
5((6BROMO(2NAPHTHYLOXY))METHYL)4(3MORPHOLIN4YLPROPYL)124TRIAZOLE3THIOL
828278100
C1COCCN1CCCN2C(=NNC2=S)COC3=CC4=C(C=C3)C=C(C=C4)Br
InChI=1SC20H23BrN4O2Sc211742161318(5315(16)1217)271419222320(28)25(19)716248102611924h251213H161114H2(H2328)
MFCD04053628
ZINC000020028567
ZINC20028567
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