Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-{(E)-[4-(methylsulfanyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL346642
SMILES CSc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN(C1CCCCC1)C)c1nonc1N
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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 C21H27N9O2S MW 469.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N9O2S/c1-29(15-6-4-3-5-7-15)13-17-18(24-28-30(17)20-19(22)26-32-27-20)21(31)25-23-12-14-8-10-16(33-2)11-9-14/h8-12,15H,3-7,13H2,1-2H3,(H2,22,26)(H,25,31)/b23-12+InChIKey
ZOLXYTNNEYQDIO-FSJBWODESA-NSynonyms
848986-91-4(E)1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N(4(methylthio)benzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((E)(4(methylsulfanyl)phenyl)methylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5((CYCLOHEXYL(METHYL)AMINO)METHYL)N((E)(4METHYLSULFANYLPHENYL)METHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
848986914
CN(CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3=CC=C(C=C3)SC)C4CCCCC4
InChI=1SC21H27N9O2Sc129(156435715)131718(242830(17)2019(22)26322720)21(31)2523121481016(332)11914h81215H3713H212H3(H22226)(H2531)b2312+
MFCD05678535
ZINC000002446054
ZINC33372611
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