Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1Z)-6-methoxy-3,4-dihydronaphthalen-1(2H)-ylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK754166
SMILES COc1ccc2c(c1)CCC/C/2=N/NC(=O)c1nnn(c1c1ccccc1)c1nonc1N
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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 C22H20N8O3 MW 444.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N8O3/c1-32-15-10-11-16-14(12-15)8-5-9-17(16)24-26-22(31)18-19(13-6-3-2-4-7-13)30(29-25-18)21-20(23)27-33-28-21/h2-4,6-7,10-12H,5,8-9H2,1H3,(H2,23,27)(H,26,31)/b24-17-InChIKey
PYUMCGWSXNQGDL-ULJHMMPZSA-NSynonyms
1(4AMINO125OXADIAZOL3YL)N((1Z)6METHOXY34DIHYDRONAPHTHALEN1(2H)YLIDENE)5PHENYL1H123TRIAZOLE4CARBOHYDRAZIDE
1(4amino125oxadiazol3yl)N((Z)(6methoxy34dihydro2Hnaphthalen1ylidene)amino)5phenyltriazole4carboxamide
COC1=CC2=C(C=C1)C(=NNC(=O)C3=C(N(N=N3)C4=NON=C4N)C5=CC=CC=C5)CCC2
COc1ccc2c(c1)CCCC2=NNC(=O)c1nnn(c1c1ccccc1)c1nonc1N
InChI=1SC22H20N8O3c1321510111614(1215)85917(16)242622(31)1819(136324713)30(292518)2120(23)27332821h24671012H589H21H3(H22327)(H2631)b2417
MFCD00759664
ZINC000100051199
ZINC15161966
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