Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-(5-methylthiophen-2-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL348153
SMILES CN(C1CCCCC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(s1)C
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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 C19H25N9O2S MW 443.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N9O2S/c1-12-8-9-14(31-12)10-21-23-19(29)16-15(11-27(2)13-6-4-3-5-7-13)28(26-22-16)18-17(20)24-30-25-18/h8-10,13H,3-7,11H2,1-2H3,(H2,20,24)(H,23,29)/b21-10+InChIKey
YRXQZBMMCGYZTI-UFFVCSGVSA-NSynonyms
861645-78-5(E)1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((5methylthiophen2yl)methylene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((E)(5methylthiophen2yl)methylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((E)(5methylthiophen2yl)methylideneamino)triazole4carboxamide
861645785
CC1=CC=C(S1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CN(C)C4CCCCC4
CN(C1CCCCC1)Cc1c(nnn1c1nonc1N)C(=O)NN=Cc1ccc(s1)C
InChI=1SC19H25N9O2Sc1128914(3112)10212319(29)1615(1127(2)136435713)28(262216)1817(20)24302518h81013H3711H212H3(H22024)(H2329)b2110+
MFCD05686240
ZINC000009496820
ZINC33906444
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