Vitas-M small molecule compound
N'-[(E)-(3-chlorophenyl)methylidene]-2-{[5-{[(4-iodophenyl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STL171411
SMILES C=CCn1c(SCC(=O)N/N=C/c2cccc(c2)Cl)nnc1CNc1ccc(cc1)I
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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 C21H20ClIN6OS MW 566.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClIN6OS/c1-2-10-29-19(13-24-18-8-6-17(23)7-9-18)26-28-21(29)31-14-20(30)27-25-12-15-4-3-5-16(22)11-15/h2-9,11-12,24H,1,10,13-14H2,(H,27,30)/b25-12+InChIKey
NXTAOYNNGMXNBH-BRJLIKDPSA-NSynonyms
570417-88-82((4ALLYL5((4IODOANILINO)METHYL)4H124TRIAZOL3YL)SULFANYL)N(3CHLOROBENZYLIDENE)ACETOHYDRAZIDE
570417888
C=CCN1C(=NN=C1SCC(=O)NN=CC2=CC(=CC=C2)Cl)CNC3=CC=C(C=C3)I
C=CCn1c(SCC(=O)NN=Cc2cccc(c2)Cl)nnc1CNc1ccc(cc1)I
InChI=1SC21H20ClIN6OSc12102919(1324188617(23)7918)262821(29)311420(30)2725121543516(22)1115h29111224H1101314H2(H2730)b2512+
MFCD01436747
N((E)(3chlorophenyl)methylidene)2((5(((4iodophenyl)amino)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetohydrazide
N((E)(3CHLOROPHENYL)METHYLIDENEAMINO)2((5((4IODOANILINO)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002097627
ZINC100403508
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