Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-5-[(phenylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK548607
SMILES COc1cc(/C=N/NC(=O)c2nnn(c2CNc2ccccc2)c2nonc2N)ccc1OC
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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 C21H21N9O4 MW 463.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N9O4/c1-32-16-9-8-13(10-17(16)33-2)11-24-26-21(31)18-15(12-23-14-6-4-3-5-7-14)30(29-25-18)20-19(22)27-34-28-20/h3-11,23H,12H2,1-2H3,(H2,22,27)(H,26,31)/b24-11+InChIKey
VZEOCJNBLHCELE-BHGWPJFGSA-NSynonyms
799772-11-5(E)1(4amino125oxadiazol3yl)N(34dimethoxybenzylidene)5((phenylamino)methyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5(ANILINOMETHYL)N((E)(34DIMETHOXYPHENYL)METHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
1(4amino125oxadiazol3yl)N((E)(34dimethoxyphenyl)methylidene)5((phenylamino)methyl)1H123triazole4carbohydrazide
799772115
COC1=C(C=C(C=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CNC4=CC=CC=C4)OC
COc1cc(C=NNC(=O)c2nnn(c2CNc2ccccc2)c2nonc2N)ccc1OC
InChI=1SC21H21N9O4c132169813(1017(16)332)11242621(31)1815(1223146435714)30(292518)2019(22)27342820h31123H12H212H3(H22227)(H2631)b2411+
MFCD03339783
ZINC000002205282
ZINC33350349
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