Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3,4-dihydroisoquinolin-2(1H)-ylmethyl)-N'-[(E)-(2-methoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK760365
SMILES COc1ccccc1/C=N/NC(=O)c1nnn(c1CN1CCc2c(C1)cccc2)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 C23H23N9O3 MW 473.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N9O3/c1-34-19-9-5-4-7-16(19)12-25-27-23(33)20-18(32(30-26-20)22-21(24)28-35-29-22)14-31-11-10-15-6-2-3-8-17(15)13-31/h2-9,12H,10-11,13-14H2,1H3,(H2,24,28)(H,27,33)/b25-12+InChIKey
NASDAEFRAFUYKK-BRJLIKDPSA-NSynonyms
1(4amino125oxadiazol3yl)5(34dihydro1Hisoquinolin2ylmethyl)N((E)(2methoxyphenyl)methylideneamino)triazole4carboxamide
1(4amino125oxadiazol3yl)5(34dihydroisoquinolin2(1H)ylmethyl)N((E)(2methoxyphenyl)methylidene)1H123triazole4carbohydrazide
COC1=CC=CC=C1C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CN4CCC5=CC=CC=C5C4
COc1ccccc1C=NNC(=O)c1nnn(c1CN1CCc2c(C1)cccc2)c1nonc1N
InChI=1SC23H23N9O3c13419954716(19)12252723(33)2018(32(302620)2221(24)28352922)1431111015623817(15)1331h2912H10111314H21H3(H22428)(H2733)b2512+
MFCD01821533
ZINC000019830866
ZINC33335946
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