Vitas-M small molecule compound
3-(azepan-1-ylmethyl)-6-[(E)-2-(2-methoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL086173
SMILES COc1ccccc1/C=C/c1nn2c(s1)nnc2CN1CCCCCC1
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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 C19H23N5OS MW 369.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N5OS/c1-25-16-9-5-4-8-15(16)10-11-18-22-24-17(20-21-19(24)26-18)14-23-12-6-2-3-7-13-23/h4-5,8-11H,2-3,6-7,12-14H2,1H3/b11-10+InChIKey
VTVVUVOZSMFGCC-ZHACJKMWSA-NSynonyms
1261027-70-6(E)3(azepan1ylmethyl)6(2methoxystyryl)(124)triazolo(34b)(134)thiadiazole
1261027706
3(1AZEPANYLMETHYL)6(2(2METHOXYPHENYL)VINYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
3(azepan1ylmethyl)6((E)2(2methoxyphenyl)ethenyl)(124)triazolo(34b)(134)thiadiazole
COC1=CC=CC=C1C=CC2=NN3C(=NN=C3S2)CN4CCCCCC4
COc1ccccc1C=Cc1nn2c(s1)nnc2CN1CCCCCC1
InChI=1SC19H23N5OSc12516954815(16)101118222417(202119(24)2618)14231262371323h45811H23671214H21H3b1110+
MFCD18203619
ZINC000057524666
ZINC57524666
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