Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,5-dichloro-2-methoxyphenyl)methylidene]-5-[(4-methylpiperidin-1-yl)methyl]-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STK547183
SMILES COc1c(/C=N/NC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)cc(cc1Cl)Cl

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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 C20H23Cl2N9O3 MW 508.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23Cl2N9O3/c1-11-3-5-30(6-4-11)10-15-16(25-29-31(15)19-18(23)27-34-28-19)20(32)26-24-9-12-7-13(21)8-14(22)17(12)33-2/h7-9,11H,3-6,10H2,1-2H3,(H2,23,27)(H,26,32)/b24-9+
InChIKey
QKBRQORXWPLIHL-PGGKNCGUSA-N
Synonyms
488131-25-5
(E)1(4amino125oxadiazol3yl)N(35dichloro2methoxybenzylidene)5((4methylpiperidin1yl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(35dichloro2methoxyphenyl)methylidene)5((4methylpiperidin1yl)methyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)(35DICHLORO2METHOXYPHENYL)METHYLIDENEAMINO)5((4METHYLPIPERIDIN1YL)METHYL)TRIAZOLE4CARBOXAMIDE
488131255
CC1CCN(CC1)CC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC(=CC(=C4OC)Cl)Cl
COc1c(C=NNC(=O)c2nnn(c2CN2CCC(CC2)C)c2nonc2N)cc(cc1Cl)Cl
InChI=1SC20H23Cl2N9O3c1113530(6411)101516(252931(15)1918(23)27342819)20(32)2624912713(21)814(22)17(12)332h7911H3610H212H3(H22327)(H2632)b249+
MFCD03289847
ZINC000002331540
ZINC15979201

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Available files

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