Vitas-M small molecule compound
3-({[4-(1,3-benzodioxol-5-yl)-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)pyridine
Catalog ID
STK665941
SMILES COc1c(OC)cc(cc1OC)c1nnc(n1c1ccc2c(c1)OCO2)SCc1cccnc1
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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 C24H22N4O5S MW 478.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O5S/c1-29-20-9-16(10-21(30-2)22(20)31-3)23-26-27-24(34-13-15-5-4-8-25-12-15)28(23)17-6-7-18-19(11-17)33-14-32-18/h4-12H,13-14H2,1-3H3InChIKey
FORWGCRVQKWCJA-UHFFFAOYSA-NSynonyms
3(((4(13benzodioxol5yl)5(345trimethoxyphenyl)4H124triazol3yl)sulfanyl)methyl)pyridine
3((4(13benzodioxol5yl)5(345trimethoxyphenyl)124triazol3yl)sulfanylmethyl)pyridine
COC1=CC(=CC(=C1OC)OC)C2=NN=C(N2C3=CC4=C(C=C3)OCO4)SCC5=CN=CC=C5
InChI=1SC24H22N4O5Sc12920916(1021(302)22(20)313)23262724(341315548251215)28(23)17671819(1117)33143218h412H1314H213H3
MFCD12972458
ZINC000030947840
ZINC30947840
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