Vitas-M small molecule compound
2-(4-{[(1Z)-4-{4-methyl-3-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}phthalazin-1(2H)-ylidene]amino}phenoxy)-1-(4-phenylpiperazin-1-yl)ethanone
Catalog ID
STL046225
SMILES CN1CCN(CC1)S(=O)(=O)c1cc(ccc1C)c1n[nH]/c(=N\c2ccc(cc2)OCC(=O)N2CCN(CC2)c2ccccc2)/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 C38H41N7O4S MW 691.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H41N7O4S/c1-28-12-13-29(26-35(28)50(47,48)45-24-18-42(2)19-25-45)37-33-10-6-7-11-34(33)38(41-40-37)39-30-14-16-32(17-15-30)49-27-36(46)44-22-20-43(21-23-44)31-8-4-3-5-9-31/h3-17,26H,18-25,27H2,1-2H3,(H,39,41)InChIKey
XXUXJOUTFCOVCA-UHFFFAOYSA-NSynonyms
CN1CCN(CC1)S(=O)(=O)c1cc(ccc1C)c1n(nH)c(=Nc2ccc(cc2)OCC(=O)N2CCN(CC2)c2ccccc2)c2c1cccc2
MFCD04076539
ZINC000097969506
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