Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(2-chlorophenyl)methylidene]-5-{[(4-methylphenyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL346917
SMILES Cc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccccc1Cl
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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 C20H17ClN8O2S MW 468.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN8O2S/c1-12-6-8-14(9-7-12)32-11-16-17(24-28-29(16)19-18(22)26-31-27-19)20(30)25-23-10-13-4-2-3-5-15(13)21/h2-10H,11H2,1H3,(H2,22,26)(H,25,30)/b23-10+InChIKey
OVEALMLMVUHHML-AUEPDCJTSA-NSynonyms
849000-31-3(E)1(4amino125oxadiazol3yl)N(2chlorobenzylidene)5((ptolylthio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(2chlorophenyl)methylidene)5(((4methylphenyl)sulfanyl)methyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)(2CHLOROPHENYL)METHYLIDENEAMINO)5((4METHYLPHENYL)SULFANYLMETHYL)TRIAZOLE4CARBOXAMIDE
849000313
CC1=CC=C(C=C1)SCC2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC=CC=C4Cl
Cc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)NN=Cc1ccccc1Cl
InChI=1SC20H17ClN8O2Sc1126814(9712)32111617(242829(16)1918(22)26312719)20(30)25231013423515(13)21h210H11H21H3(H22226)(H2530)b2310+
MFCD05679807
ZINC000002448896
ZINC33372757
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