Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(1E)-1-(3-ethoxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STL347319
SMILES CCOc1cccc(c1)/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 C22H20N8O5 MW 476.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N8O5/c1-3-32-15-6-4-5-13(9-15)12(2)24-26-22(31)18-19(14-7-8-16-17(10-14)34-11-33-16)30(29-25-18)21-20(23)27-35-28-21/h4-10H,3,11H2,1-2H3,(H2,23,27)(H,26,31)/b24-12+
InChIKey
WSSLYUPGWJAECL-WYMPLXKRSA-N
Synonyms
849030-88-2
(E)1(4amino125oxadiazol3yl)5(benzo(d)(13)dioxol5yl)N(1(3ethoxyphenyl)ethylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((1E)1(3ethoxyphenyl)ethylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((E)1(3ethoxyphenyl)ethylideneamino)triazole4carboxamide
849030882
CCOC1=CC=CC(=C1)C(=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC5=C(C=C4)OCO5)C
CCOc1cccc(c1)C(=NNC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)C
InChI=1SC22H20N8O5c13321564513(915)12(2)242622(31)1819(14781617(1014)34113316)30(292518)2120(23)27352821h410H311H212H3(H22327)(H2631)b2412+
MFCD05681877
ZINC000009307027
ZINC33591723

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Available files

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