Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(2E)-4-phenylbutan-2-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL309167
SMILES C/C(=N\NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)/CCc1ccccc1
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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 C22H20N8O4 MW 460.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N8O4/c1-13(7-8-14-5-3-2-4-6-14)24-26-22(31)18-19(15-9-10-16-17(11-15)33-12-32-16)30(29-25-18)21-20(23)27-34-28-21/h2-6,9-11H,7-8,12H2,1H3,(H2,23,27)(H,26,31)/b24-13+InChIKey
DGMDMFZXPMGXJR-ZMOGYAJESA-NSynonyms
861138-64-9(E)1(4amino125oxadiazol3yl)5(benzo(d)(13)dioxol5yl)N(4phenylbutan2ylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((2E)4phenylbutan2ylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((E)4phenylbutan2ylideneamino)triazole4carboxamide
861138649
CC(=NNC(=O)C1=C(N(N=N1)C2=NON=C2N)C3=CC4=C(C=C3)OCO4)CCC5=CC=CC=C5
CC(=NNC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)CCc1ccccc1
InChI=1SC22H20N8O4c113(78145324614)242622(31)1819(159101617(1115)33123216)30(292518)2120(23)27342821h26911H7812H21H3(H22327)(H2631)b2413+
MFCD05683682
ZINC000013804141
ZINC33603888
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