Vitas-M small molecule compound
3-(azepan-1-ylmethyl)-6-(5,6,7,8-tetrahydronaphthalen-2-ylmethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL145824
SMILES C1CCCN(CC1)Cc1nnc2n1nc(s2)Cc1ccc2c(c1)CCCC2
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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 C21H27N5S MW 381.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5S/c1-2-6-12-25(11-5-1)15-19-22-23-21-26(19)24-20(27-21)14-16-9-10-17-7-3-4-8-18(17)13-16/h9-10,13H,1-8,11-12,14-15H2InChIKey
PLTNLCJMDXYTIK-UHFFFAOYSA-NSynonyms
1246054-75-01246054750
3(azepan1ylmethyl)6((5678tetrahydronaphthalen2yl)methyl)(124)triazolo(34b)(134)thiadiazole
3(azepan1ylmethyl)6(5678tetrahydronaphthalen2ylmethyl)(124)triazolo(34b)(134)thiadiazole
C1CCCN(CC1)CC2=NN=C3N2N=C(S3)CC4=CC5=C(CCCC5)C=C4
InChI=1SC21H27N5Sc1261225(1151)151922232126(19)2420(2721)141691017734818(17)1316h91013H1811121415H2
MFCD18068119
ZINC000049547816
ZINC49547816
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