Vitas-M small molecule compound
4-(4-benzylpiperidin-1-yl)-6-[(2E)-2-{3-bromo-4-[(2,4-dichlorobenzyl)oxy]-5-methoxybenzylidene}hydrazinyl]-N-(4-methoxyphenyl)-1,3,5-triazin-2-amine
Catalog ID
STK674780
SMILES COc1ccc(cc1)Nc1nc(N/N=C/c2cc(Br)c(c(c2)OC)OCc2ccc(cc2Cl)Cl)nc(n1)N1CCC(CC1)Cc1ccccc1
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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 C37H36BrCl2N7O3 MW 777.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H36BrCl2N7O3/c1-48-30-12-10-29(11-13-30)42-35-43-36(45-37(44-35)47-16-14-25(15-17-47)18-24-6-4-3-5-7-24)46-41-22-26-19-31(38)34(33(20-26)49-2)50-23-27-8-9-28(39)21-32(27)40/h3-13,19-22,25H,14-18,23H2,1-2H3,(H2,42,43,44,45,46)/b41-22+InChIKey
UGIUZBNHNCQRRB-YNPASXIJSA-NSynonyms
4(4benzylpiperidin1yl)6((2E)2(3bromo4((24dichlorobenzyl)oxy)5methoxybenzylidene)hydrazinyl)N(4methoxyphenyl)135triazin2amine
6(4benzylpiperidin1yl)2N((E)(3bromo4((24dichlorophenyl)methoxy)5methoxyphenyl)methylideneamino)4N(4methoxyphenyl)135triazine24diamine
COC1=CC=C(C=C1)NC2=NC(=NC(=N2)N3CCC(CC3)CC4=CC=CC=C4)NN=CC5=CC(=C(C(=C5)Br)OCC6=C(C=C(C=C6)Cl)Cl)OC
COc1ccc(cc1)Nc1nc(NN=Cc2cc(Br)c(c(c2)OC)OCc2ccc(cc2Cl)Cl)nc(n1)N1CCC(CC1)Cc1ccccc1
InChI=1SC37H36BrCl2N7O3c14830121029(111330)42354336(4537(4435)47161425(151747)18246435724)464122261931(38)34(33(2026)492)5023278928(39)2132(27)40h313192225H141823H212H3(H24243444546)b4122+
MFCD01029882
ZINC000008405848
ZINC150608245
Check stock
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Check stock on Vitas-MAvailable files
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