Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3Z)-5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-5-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK598284
SMILES Brc1ccc2c(c1)/C(=N/NC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N)/C(=O)N2
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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 C17H13BrN12O3S MW 545.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13BrN12O3S/c1-29-6-20-25-17(29)34-5-10-12(23-28-30(10)14-13(19)26-33-27-14)16(32)24-22-11-8-4-7(18)2-3-9(8)21-15(11)31/h2-4,6H,5H2,1H3,(H2,19,26)(H,24,32)(H,21,22,31)InChIKey
KLHGMMPDTWQKCM-UHFFFAOYSA-NSynonyms
(Z)1(4amino125oxadiazol3yl)N(5bromo2oxoindolin3ylidene)5(((4methyl4H124triazol3yl)thio)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((3Z)5bromo2oxo12dihydro3Hindol3ylidene)5(((4methyl4H124triazol3yl)sulfanyl)methyl)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N(5BROMO2OXOINDOL3YL)5((4METHYL124TRIAZOL3YL)SULFANYLMETHYL)TRIAZOLE4CARBOHYDRAZIDE
Brc1ccc2c(c1)C(=NNC(=O)c1nnn(c1CSc1nncn1C)c1nonc1N)C(=O)N2
CN1C=NN=C1SCC2=C(N=NN2C3=NON=C3N)C(=O)NNC4=C5C=C(C=CC5=NC4=O)Br
InChI=1SC17H13BrN12O3Sc1296202517(29)3451012(232830(10)1413(19)26332714)16(32)242211847(18)239(8)2115(11)31h246H5H21H3(H21926)(H2432)(H212231)
MFCD06778799
ZINC000101336461
ZINC101336461
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