Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(1E)-1-(4-cyanophenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL002115
SMILES N#Cc1ccc(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 C21H15N9O4 MW 457.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N9O4/c1-11(13-4-2-12(9-22)3-5-13)24-26-21(31)17-18(14-6-7-15-16(8-14)33-10-32-15)30(29-25-17)20-19(23)27-34-28-20/h2-8H,10H2,1H3,(H2,23,27)(H,26,31)/b24-11+InChIKey
JBAYXNSKYCCWNH-BHGWPJFGSA-NSynonyms
862184-16-5(E)1(4amino125oxadiazol3yl)5(benzo(d)(13)dioxol5yl)N(1(4cyanophenyl)ethylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((1E)1(4cyanophenyl)ethylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((E)1(4cyanophenyl)ethylideneamino)triazole4carboxamide
862184165
CC(=NNC(=O)C1=C(N(N=N1)C2=NON=C2N)C3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)C#N
InChI=1SC21H15N9O4c111(134212(922)3513)242621(31)1718(14671516(814)33103215)30(292517)2019(23)27342820h28H10H21H3(H22327)(H2631)b2411+
MFCD05687756
N#Cc1ccc(cc1)C(=NNC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)C
ZINC000009499260
ZINC33468245
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