Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(1E)-1-(4-propoxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL347409
SMILES CCCOc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)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 C23H22N8O5 MW 490.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N8O5/c1-3-10-33-16-7-4-14(5-8-16)13(2)25-27-23(32)19-20(15-6-9-17-18(11-15)35-12-34-17)31(30-26-19)22-21(24)28-36-29-22/h4-9,11H,3,10,12H2,1-2H3,(H2,24,28)(H,27,32)/b25-13+InChIKey
YJWASNRKIRCACK-DHRITJCHSA-NSynonyms
849035-12-7(E)1(4amino125oxadiazol3yl)5(benzo(d)(13)dioxol5yl)N(1(4propoxyphenyl)ethylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((1E)1(4propoxyphenyl)ethylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((E)1(4propoxyphenyl)ethylideneamino)triazole4carboxamide
849035127
CCCOC1=CC=C(C=C1)C(=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC5=C(C=C4)OCO5)C
CCCOc1ccc(cc1)C(=NNC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)C
InChI=1SC23H22N8O5c131033167414(5816)13(2)252723(32)1920(15691718(1115)35123417)31(302619)2221(24)28362922h4911H31012H212H3(H22428)(H2732)b2513+
MFCD05682321
ZINC000009307193
ZINC34829014
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