Vitas-M small molecule compound
2-{4-[(1E)-1-{2-[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}ethyl]phenyl}hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STL427756
SMILES O=C1N(c2ccc(cc2)/C(=N/Nc2nc(nc(n2)N2CCCCC2)N2CCCCC2)/C)C(=O)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 C29H38N8O2 MW 530.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H38N8O2/c1-20(21-12-14-22(15-13-21)37-25(38)23-10-4-5-11-24(23)26(37)39)33-34-27-30-28(35-16-6-2-7-17-35)32-29(31-27)36-18-8-3-9-19-36/h12-15,23-24H,2-11,16-19H2,1H3,(H,30,31,32,34)/b33-20+InChIKey
ZCQNJMRVLCOJMK-FMFFXOCNSA-NSynonyms
2(4((1E)1(2(46di(piperidin1yl)135triazin2yl)hydrazinylidene)ethyl)phenyl)hexahydro1Hisoindole13(2H)dione
2(4((E)N((46di(piperidin1yl)135triazin2yl)amino)Cmethylcarbonimidoyl)phenyl)3a45677ahexahydroisoindole13dione
CC(=NNC1=NC(=NC(=N1)N2CCCCC2)N3CCCCC3)C4=CC=C(C=C4)N5C(=O)C6CCCCC6C5=O
InChI=1SC29H38N8O2c120(21121422(151321)3725(38)2310451124(23)26(37)39)3334273028(35166271735)3229(3127)36188391936h12152324H2111619H21H3(H30313234)b3320+
MFCD01080136
O=C1N(c2ccc(cc2)C(=NNc2nc(nc(n2)N2CCCCC2)N2CCCCC2)C)C(=O)C2C1CCCC2
ZINC000008872067
ZINC000096232850
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