Vitas-M small molecule compound
3-(azepan-1-ylmethyl)-6-[(2-chlorophenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL086168
SMILES Clc1ccccc1OCc1nn2c(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 C17H20ClN5OS MW 377.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20ClN5OS/c18-13-7-3-4-8-14(13)24-12-16-21-23-15(19-20-17(23)25-16)11-22-9-5-1-2-6-10-22/h3-4,7-8H,1-2,5-6,9-12H2InChIKey
VCLUKQJISIEMPV-UHFFFAOYSA-NSynonyms
1260905-17-6(3(1AZEPANYLMETHYL)(124)TRIAZOLO(34B)(134)THIADIAZOL6YL)METHYL2CHLOROPHENYLETHER
1260905176
3(azepan1ylmethyl)6((2chlorophenoxy)methyl)(124)triazolo(34b)(134)thiadiazole
C1CCCN(CC1)CC2=NN=C3N2N=C(S3)COC4=CC=CC=C4Cl
InChI=1SC17H20ClN5OSc1813734814(13)241216212315(192017(23)2516)1122951261022h3478H1256912H2
MFCD18203616
ZINC000057524648
ZINC57524648
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