Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(piperidin-1-ylmethyl)-N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK547022
SMILES COc1c(/C=N/NC(=O)c2nnn(c2CN2CCCCC2)c2nonc2N)ccc(c1OC)OC
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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 C21H27N9O5 MW 485.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N9O5/c1-32-15-8-7-13(17(33-2)18(15)34-3)11-23-25-21(31)16-14(12-29-9-5-4-6-10-29)30(28-24-16)20-19(22)26-35-27-20/h7-8,11H,4-6,9-10,12H2,1-3H3,(H2,22,26)(H,25,31)/b23-11+InChIKey
XTPHRHNFOPQSOB-FOKLQQMPSA-NSynonyms
488744-84-9(E)1(4amino125oxadiazol3yl)5(piperidin1ylmethyl)N(234trimethoxybenzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(piperidin1ylmethyl)N((E)(234trimethoxyphenyl)methylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5(PIPERIDIN1YLMETHYL)N((E)(234TRIMETHOXYPHENYL)METHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
488744849
COC1=C(C(=C(C=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CN4CCCCC4)OC)OC
COc1c(C=NNC(=O)c2nnn(c2CN2CCCCC2)c2nonc2N)ccc(c1OC)OC
InChI=1SC21H27N9O5c132158713(17(332)18(15)343)11232521(31)1614(122995461029)30(282416)2019(22)26352720h7811H4691012H213H3(H22226)(H2531)b2311+
MFCD03292239
ZINC000002340090
ZINC33361871
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