Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2,5-difluorophenyl)methylidene]-5-{[(4-methylphenyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL347513
SMILES Cc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(F)ccc1F
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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 C20H16F2N8O2S MW 470.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16F2N8O2S/c1-11-2-5-14(6-3-11)33-10-16-17(25-29-30(16)19-18(23)27-32-28-19)20(31)26-24-9-12-8-13(21)4-7-15(12)22/h2-9H,10H2,1H3,(H2,23,27)(H,26,31)/b24-9+InChIKey
VOKDKHWODWGDPC-PGGKNCGUSA-NSynonyms
861115-77-7(E)1(4amino125oxadiazol3yl)N(25difluorobenzylidene)5((ptolylthio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(25difluorophenyl)methylidene)5(((4methylphenyl)sulfanyl)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(25difluorophenyl)methylideneamino)5((4methylphenyl)sulfanylmethyl)triazole4carboxamide
861115777
CC1=CC=C(C=C1)SCC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=C(C=CC(=C4)F)F
Cc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)NN=Cc1cc(F)ccc1F
InChI=1SC20H16F2N8O2Sc1112514(6311)33101617(252930(16)1918(23)27322819)20(31)2624912813(21)4715(12)22h29H10H21H3(H22327)(H2631)b249+
MFCD05682786
ZINC000009307448
ZINC33618545
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