Vitas-M small molecule compound
1-(azepan-1-yl)-4-[6-(3,5-dimethyl-1H-pyrazol-1-yl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]butan-1-one
Catalog ID
STL251367
SMILES O=C(N1CCCCCC1)CCCc1nnc2n1nc(cc2)n1nc(cc1C)C
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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 C20H27N7O MW 381.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N7O/c1-15-14-16(2)26(23-15)19-11-10-18-22-21-17(27(18)24-19)8-7-9-20(28)25-12-5-3-4-6-13-25/h10-11,14H,3-9,12-13H2,1-2H3InChIKey
VZOUOMWEFXLOOA-UHFFFAOYSA-NSynonyms
1374525-05-91(azepan1yl)4(6(35dimethyl1Hpyrazol1yl)(124)triazolo(43b)pyridazin3yl)butan1one
1(azepan1yl)4(6(35dimethylpyrazol1yl)(124)triazolo(43b)pyridazin3yl)butan1one
1374525059
CC1=CC(=NN1C2=NN3C(=NN=C3CCCC(=O)N4CCCCCC4)C=C2)C
InChI=1SC20H27N7Oc1151416(2)26(2315)19111018222117(27(18)2419)87920(28)251253461325h101114H391213H212H3
MFCD22201917
ZINC000072403088
ZINC72403088
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