Vitas-M small molecule compound
3-(azepan-1-ylmethyl)-6-(1-phenoxyethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL112723
SMILES CC(c1sc2n(n1)c(nn2)CN1CCCCCC1)Oc1ccccc1
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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 C18H23N5OS MW 357.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N5OS/c1-14(24-15-9-5-4-6-10-15)17-21-23-16(19-20-18(23)25-17)13-22-11-7-2-3-8-12-22/h4-6,9-10,14H,2-3,7-8,11-13H2,1H3InChIKey
TVBKKRAVHPOJPV-UHFFFAOYSA-NSynonyms
3(azepan1ylmethyl)6(1phenoxyethyl)(124)triazolo(34b)(134)thiadiazole
CC(C1=NN2C(=NN=C2S1)CN3CCCCCC3)OC4=CC=CC=C4
InChI=1SC18H23N5OSc114(241595461015)17212316(192018(23)2517)13221172381222h4691014H23781113H21H3
MFCD19026940
ZINC000067239884
ZINC000067239885
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