Vitas-M small molecule compound
3-(azepan-1-ylmethyl)-6-[(E)-2-(4-methoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL086174
SMILES COc1ccc(cc1)/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/c1-25-16-9-6-15(7-10-16)8-11-18-22-24-17(20-21-19(24)26-18)14-23-12-4-2-3-5-13-23/h6-11H,2-5,12-14H2,1H3/b11-8+InChIKey
CGZSZNOIUBHPRU-DHZHZOJOSA-NSynonyms
1246086-19-0(E)3(azepan1ylmethyl)6(4methoxystyryl)(124)triazolo(34b)(134)thiadiazole
1246086190
3(1AZEPANYLMETHYL)6(2(4METHOXYPHENYL)VINYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
3(azepan1ylmethyl)6((E)2(4methoxyphenyl)ethenyl)(124)triazolo(34b)(134)thiadiazole
COC1=CC=C(C=C1)C=CC2=NN3C(=NN=C3S2)CN4CCCCCC4
COc1ccc(cc1)C=Cc1nn2c(s1)nnc2CN1CCCCCC1
InChI=1SC19H23N5OSc125169615(71016)81118222417(202119(24)2618)14231242351323h611H251214H21H3b118+
MFCD18067080
ZINC000049546284
ZINC49546284
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