Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-chlorophenyl)methylidene]-5-(4-propoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STK575705
SMILES CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)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 C21H19ClN8O3 MW 466.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN8O3/c1-2-10-32-16-8-6-14(7-9-16)18-17(25-29-30(18)20-19(23)27-33-28-20)21(31)26-24-12-13-4-3-5-15(22)11-13/h3-9,11-12H,2,10H2,1H3,(H2,23,27)(H,26,31)/b24-12+
InChIKey
CNLLZPKZYCVHPW-WYMPLXKRSA-N
Synonyms
899412-30-7
(E)1(4amino125oxadiazol3yl)N(3chlorobenzylidene)5(4propoxyphenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3chlorophenyl)methylidene)5(4propoxyphenyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)(3CHLOROPHENYL)METHYLIDENEAMINO)5(4PROPOXYPHENYL)TRIAZOLE4CARBOXAMIDE
899412307
CCCOC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC(=CC=C4)Cl
CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)NN=Cc1cccc(c1)Cl
InChI=1SC21H19ClN8O3c121032168614(7916)1817(252930(18)2019(23)27332820)21(31)2624121343515(22)1113h391112H210H21H3(H22327)(H2631)b2412+
MFCD06605654
ZINC000002325542
ZINC33360636

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Available files

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