Vitas-M small molecule compound
methyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(azepan-1-ylmethyl)-1H-1,2,3-triazole-4-carboxylate
Catalog ID
STK674105
SMILES COC(=O)c1nnn(c1CN1CCCCCC1)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 C13H19N7O3 MW 321.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19N7O3/c1-22-13(21)10-9(8-19-6-4-2-3-5-7-19)20(18-15-10)12-11(14)16-23-17-12/h2-8H2,1H3,(H2,14,16)InChIKey
YXBOFHBGWUHVKV-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(N(N=N1)C2=NON=C2N)CN3CCCCCC3
InChI=1SC13H19N7O3c12213(21)109(81964235719)20(181510)1211(14)16231712h28H21H3(H21416)
METHYL1(4AMINO125OXADIAZOL3YL)5(1AZEPANYLMETHYL)1H123TRIAZOLE4CARBOXYLATE
methyl1(4amino125oxadiazol3yl)5(azepan1ylmethyl)1H123triazole4carboxylate
METHYL1(4AMINO125OXADIAZOL3YL)5(AZEPAN1YLMETHYL)TRIAZOLE4CARBOXYLATE
MFCD01306056
ZINC000000051801
ZINC51801
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