Vitas-M small molecule compound
3-(azepan-1-ylmethyl)-6-[(2,4-dichlorophenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL145825
SMILES Clc1ccc(c(c1)Cl)OCc1nn2c(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 C17H19Cl2N5OS MW 412.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19Cl2N5OS/c18-12-5-6-14(13(19)9-12)25-11-16-22-24-15(20-21-17(24)26-16)10-23-7-3-1-2-4-8-23/h5-6,9H,1-4,7-8,10-11H2InChIKey
WZPNWOFEEWXXKG-UHFFFAOYSA-NSynonyms
1246068-06-31246068063
3(1AZEPANYLMETHYL)6((24DICHLOROPHENOXY)METHYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
3(azepan1ylmethyl)6((24dichlorophenoxy)methyl)(124)triazolo(34b)(134)thiadiazole
C1CCCN(CC1)CC2=NN=C3N2N=C(S3)COC4=C(C=C(C=C4)Cl)Cl
InChI=1SC17H19Cl2N5OSc18125614(13(19)912)251116222415(202117(24)2616)102373124823h569H14781011H2
MFCD18067670
ZINC000049547100
ZINC49547100
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