Vitas-M small molecule compound

4-[(E)-{2-[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]hydrazinylidene}methyl]phenyl 2-chlorobenzoate

Catalog ID
STL427791
SMILES O=C(c1ccccc1Cl)Oc1ccc(cc1)/C=N/Nc1nc(nc(n1)N1CCCCC1)N1CCCCC1

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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 C27H30ClN7O2 MW 520.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30ClN7O2/c28-23-10-4-3-9-22(23)24(36)37-21-13-11-20(12-14-21)19-29-33-25-30-26(34-15-5-1-6-16-34)32-27(31-25)35-17-7-2-8-18-35/h3-4,9-14,19H,1-2,5-8,15-18H2,(H,30,31,32,33)/b29-19+
InChIKey
LLRYXCUAOWAPAQ-VUTHCHCSSA-N
Synonyms

(4((E)((46di(piperidin1yl)135triazin2yl)hydrazinylidene)methyl)phenyl)2chlorobenzoate
4((1E)2((46DIPIPERIDYL(135TRIAZIN2YL))AMINO)2AZAVINYL)PHENYL2CHLOROBENZOATE
4((E)(2(46di(piperidin1yl)135triazin2yl)hydrazinylidene)methyl)phenyl2chlorobenzoate
4(2(46DI(1PIPERIDINYL)135TRIAZIN2YL)CARBOHYDRAZONOYL)PHENYL2CHLOROBENZOATE
C1CCN(CC1)C2=NC(=NC(=N2)NN=CC3=CC=C(C=C3)OC(=O)C4=CC=CC=C4Cl)N5CCCCC5
InChI=1SC27H30ClN7O2c28231043922(23)24(36)3721131120(121421)192933253026(34155161634)3227(3125)35177281835h3491419H12581518H2(H30313233)b2919+
MFCD00658817
O=C(c1ccccc1Cl)Oc1ccc(cc1)C=NNc1nc(nc(n1)N1CCCCC1)N1CCCCC1
ZINC000008386470
ZINC33908955

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Available files

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