Vitas-M small molecule compound
2-[4-({4-[4-methyl-3-(piperidin-1-ylsulfonyl)phenyl]phthalazin-1-yl}amino)phenoxy]-1-(4-phenylpiperazin-1-yl)ethanone
Catalog ID
STK238501
SMILES O=C(N1CCN(CC1)c1ccccc1)COc1ccc(cc1)Nc1nnc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N1CCCCC1)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 C38H40N6O4S MW 676.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H40N6O4S/c1-28-14-15-29(26-35(28)49(46,47)44-20-8-3-9-21-44)37-33-12-6-7-13-34(33)38(41-40-37)39-30-16-18-32(19-17-30)48-27-36(45)43-24-22-42(23-25-43)31-10-4-2-5-11-31/h2,4-7,10-19,26H,3,8-9,20-25,27H2,1H3,(H,39,41)InChIKey
ZQGXIRISIWTLPH-UHFFFAOYSA-NSynonyms
2(4((4(4methyl3(piperidin1ylsulfonyl)phenyl)phthalazin1yl)amino)phenoxy)1(4phenylpiperazin1yl)ethanone
2(4((4(4METHYL3PIPERIDIN1YLSULFONYLPHENYL)PHTHALAZIN1YL)AMINO)PHENOXY)1(4PHENYLPIPERAZIN1YL)ETHANONE
CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)OCC(=O)N5CCN(CC5)C6=CC=CC=C6)S(=O)(=O)N7CCCCC7
InChI=1SC38H40N6O4Sc128141529(2635(28)49(4647)44208392144)373312671334(33)38(414037)3930161832(191730)482736(45)43242242(232543)31104251131h247101926H389202527H21H3(H3941)
MFCD03682565
ZINC97969056
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