Vitas-M small molecule compound
2-phenyl-5-[({4-(prop-2-en-1-yl)-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)methyl]-1,3,4-oxadiazole
Catalog ID
STK251276
SMILES C=CCn1c(nnc1COc1ccc2c(c1)CCCC2)SCc1nnc(o1)c1ccccc1
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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 C25H25N5O2S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O2S/c1-2-14-30-22(16-31-21-13-12-18-8-6-7-11-20(18)15-21)26-29-25(30)33-17-23-27-28-24(32-23)19-9-4-3-5-10-19/h2-5,9-10,12-13,15H,1,6-8,11,14,16-17H2InChIKey
XEKKRWZWLTZCGI-UHFFFAOYSA-NSynonyms
2phenyl5(((4(prop2en1yl)5((5678tetrahydronaphthalen2yloxy)methyl)4H124triazol3yl)sulfanyl)methyl)134oxadiazole
2phenyl5((4prop2enyl5(5678tetrahydronaphthalen2yloxymethyl)124triazol3yl)sulfanylmethyl)134oxadiazole
C=CCN1C(=NN=C1SCC2=NN=C(O2)C3=CC=CC=C3)COC4=CC5=C(CCCC5)C=C4
InChI=1SC25H25N5O2Sc12143022(1631211312188671120(18)1521)262925(30)331723272824(3223)1994351019h25910121315H16811141617H2
MFCD08670414
ZINC000009699069
ZINC09699069
ZINC9699069
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