Vitas-M small molecule compound

2,4-dimethyl-N-[(1E)-4-{4-methyl-3-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}phthalazin-1(2H)-ylidene]aniline

Catalog ID
STL046065
SMILES CN1CCN(CC1)S(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N/c2ccc(cc2C)C)/c2c1cccc2

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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 C28H31N5O2S MW 501.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O2S/c1-19-9-12-25(21(3)17-19)29-28-24-8-6-5-7-23(24)27(30-31-28)22-11-10-20(2)26(18-22)36(34,35)33-15-13-32(4)14-16-33/h5-12,17-18H,13-16H2,1-4H3,(H,29,31)
InChIKey
CJKQXBJTSDBZCQ-UHFFFAOYSA-N
Synonyms
442648-08-0
442648080
CN1CCN(CC1)S(=O)(=O)c1cc(ccc1C)c1n(nH)c(=Nc2ccc(cc2C)C)c2c1cccc2
MFCD03799468

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.