Vitas-M small molecule compound
7,8-dimethoxy-3-{2-oxo-2-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethyl}-1,3-dihydro-2H-3-benzazepin-2-one
Catalog ID
STL425085
SMILES COc1cc2C=CN(C(=O)Cc2cc1OC)CC(=O)N1CCC(CC1)c1nnc2n1cccc2
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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 C25H27N5O4 MW 461.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O4/c1-33-20-13-18-8-12-29(23(31)15-19(18)14-21(20)34-2)16-24(32)28-10-6-17(7-11-28)25-27-26-22-5-3-4-9-30(22)25/h3-5,8-9,12-14,17H,6-7,10-11,15-16H2,1-2H3InChIKey
YTXOUINWRYDPFV-UHFFFAOYSA-NSynonyms
1574517-38-61574517386
3(2(4((124)triazolo(43a)pyridin3yl)piperidin1yl)2oxoethyl)78dimethoxy1Hbenzo(d)azepin2(3H)one
78dimethoxy3(2oxo2(4((124)triazolo(43a)pyridin3yl)piperidin1yl)ethyl)13dihydro2H3benzazepin2one
78dimethoxy3(2oxo2(4((124)triazolo(43a)pyridin3yl)piperidin1yl)ethyl)1H3benzazepin2one
COC1=C(C=C2C=CN(C(=O)CC2=C1)CC(=O)N3CCC(CC3)C4=NN=C5N4C=CC=C5)OC
InChI=1SC25H27N5O4c13320131881229(23(31)1519(18)1421(20)342)1624(32)2810617(71128)25272622534930(22)25h3589121417H6710111516H212H3
MFCD28058498
ZINC000096231003
ZINC96231003
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