Vitas-M small molecule compound

2-(4-{[(1Z)-4-[4-methyl-3-(piperidin-1-ylsulfonyl)phenyl]phthalazin-1(2H)-ylidene]amino}phenoxy)-1-(4-phenylpiperazin-1-yl)ethanone

Catalog ID
STL039126
SMILES O=C(N1CCN(CC1)c1ccccc1)COc1ccc(cc1)/N=c/1\[nH]nc(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-N
Synonyms

2(4(((1Z)4(4methyl3(piperidin1ylsulfonyl)phenyl)phthalazin1(2H)ylidene)amino)phenoxy)1(4phenylpiperazin1yl)ethanone
MFCD04077842
O=C(N1CCN(CC1)c1ccccc1)COc1ccc(cc1)N=c1(nH)nc(c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N1CCCCC1)C
ZINC000097969056

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Available files

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