Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(3-chlorophenyl)ethylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STL042657
SMILES Clc1cccc(c1)/C(=N/NC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N)/C

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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 C21H20ClN9O2 MW 465.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN9O2/c1-13(14-7-6-8-15(22)11-14)24-26-21(32)18-17(12-30(2)16-9-4-3-5-10-16)31(29-25-18)20-19(23)27-33-28-20/h3-11H,12H2,1-2H3,(H2,23,27)(H,26,32)/b24-13+
InChIKey
RIYHTABUNKDSFI-ZMOGYAJESA-N
Synonyms
850737-18-7
(E)1(4amino125oxadiazol3yl)N(1(3chlorophenyl)ethylidene)5((methyl(phenyl)amino)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((1E)1(3chlorophenyl)ethylidene)5((methyl(phenyl)amino)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)1(3chlorophenyl)ethylideneamino)5((Nmethylanilino)methyl)triazole4carboxamide
850737187
CC(=NNC(=O)C1=C(N(N=N1)C2=NON=C2N)CN(C)C3=CC=CC=C3)C4=CC(=CC=C4)Cl
Clc1cccc(c1)C(=NNC(=O)c1nnn(c1CN(c1ccccc1)C)c1nonc1N)C
InChI=1SC21H20ClN9O2c113(1476815(22)1114)242621(32)1817(1230(2)1694351016)31(292518)2019(23)27332820h311H12H212H3(H22327)(H2632)b2413+
MFCD05693375
ZINC000009290843
ZINC35374041

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Available files

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