Vitas-M small molecule compound

N'-{2-[(4-bromobenzyl)oxy]benzylidene}-2-{[4-(2,4-dichlorophenyl)-5-{[(2-methoxyphenyl)amino]methyl}-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

Catalog ID
STL172721
SMILES COc1ccccc1NCc1nnc(n1c1ccc(cc1Cl)Cl)SCC(=O)N/N=C/c1ccccc1OCc1ccc(cc1)Br

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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 C32H27BrCl2N6O3S MW 726.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H27BrCl2N6O3S/c1-43-29-9-5-3-7-26(29)36-18-30-38-40-32(41(30)27-15-14-24(34)16-25(27)35)45-20-31(42)39-37-17-22-6-2-4-8-28(22)44-19-21-10-12-23(33)13-11-21/h2-17,36H,18-20H2,1H3,(H,39,42)
InChIKey
LDCQHWMOXKVVRG-UHFFFAOYSA-N
Synonyms
438616-94-5
438616945
COC1=CC=CC=C1NCC2=NN=C(N2C3=C(C=C(C=C3)Cl)Cl)SCC(=O)NN=CC4=CC=CC=C4OCC5=CC=C(C=C5)Br
COc1ccccc1NCc1nnc(n1c1ccc(cc1Cl)Cl)SCC(=O)NN=Cc1ccccc1OCc1ccc(cc1)Br
InChI=1SC32H27BrCl2N6O3Sc14329953726(29)361830384032(41(30)27151424(34)1625(27)35)452031(42)39371722624828(22)441921101223(33)131121h21736H1820H21H3(H3942)
MFCD02053640
N((2((4BROMOPHENYL)METHOXY)PHENYL)METHYLIDENEAMINO)2((4(24DICHLOROPHENYL)5((2METHOXYANILINO)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2((4bromobenzyl)oxy)benzylidene)2((4(24dichlorophenyl)5(((2methoxyphenyl)amino)methyl)4H124triazol3yl)sulfanyl)acetohydrazide
N(2((4BROMOBENZYL)OXY)BENZYLIDENE)2((4(24DICHLOROPHENYL)5((2METHOXYANILINO)METHYL)4H124TRIAZOL3YL)SULFANYL)ACETOHYDRAZIDE
ZINC000245239616

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Available files

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