Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methylphenyl)sulfanyl]methyl}-N'-[(1E)-1-(pyridin-2-yl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL348494
SMILES Cc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)N/N=C(/c1ccccn1)\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 C20H19N9O2S MW 449.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N9O2S/c1-12-6-8-14(9-7-12)32-11-16-17(24-28-29(16)19-18(21)26-31-27-19)20(30)25-23-13(2)15-5-3-4-10-22-15/h3-10H,11H2,1-2H3,(H2,21,26)(H,25,30)/b23-13+InChIKey
MYEJHJKXHFYEAR-YDZHTSKRSA-NSynonyms
862185-68-0(E)1(4amino125oxadiazol3yl)N(1(pyridin2yl)ethylidene)5((ptolylthio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(((4methylphenyl)sulfanyl)methyl)N((1E)1(pyridin2yl)ethylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((4methylphenyl)sulfanylmethyl)N((E)1pyridin2ylethylideneamino)triazole4carboxamide
862185680
CC1=CC=C(C=C1)SCC2=C(N=NN2C3=NON=C3N)C(=O)NN=C(C)C4=CC=CC=N4
Cc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)NN=C(c1ccccn1)C
InChI=1SC20H19N9O2Sc1126814(9712)32111617(242829(16)1918(21)26312719)20(30)252313(2)15534102215h310H11H212H3(H22126)(H2530)b2313+
MFCD05687955
ZINC000013805762
ZINC101359112
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