Vitas-M small molecule compound
ethyl [({(Z)-[(4,6-dimethylpyrimidin-2-yl)amino][(1H-1,2,4-triazol-5-ylsulfonyl)amino]methylidene}amino)oxy]acetate
Catalog ID
STK761219
SMILES CCOC(=O)CO/N=C(\NS(=O)(=O)c1ncn[nH]1)/Nc1nc(C)cc(n1)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 C13H18N8O5S MW 398.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N8O5S/c1-4-25-10(22)6-26-20-12(18-11-16-8(2)5-9(3)17-11)21-27(23,24)13-14-7-15-19-13/h5,7H,4,6H2,1-3H3,(H,14,15,19)(H2,16,17,18,20,21)InChIKey
CBMZKWYIZRNPER-UHFFFAOYSA-NSynonyms
CCOC(=O)CON=C(NS(=O)(=O)c1ncn(nH)1)Nc1nc(C)cc(n1)C
CCOC(=O)CONC(=NS(=O)(=O)C1=NC=NN1)NC2=NC(=CC(=N2)C)C
ethyl((((Z)((46dimethylpyrimidin2yl)amino)((1H124triazol5ylsulfonyl)amino)methylidene)amino)oxy)acetate
ETHYL2(((Z)N(46DIMETHYLPYRIMIDIN2YL)N(1H124TRIAZOL5YLSULFONYL)CARBAMIMIDOYL)AMINO)OXYACETATE
ETHYL2((1Z)2((46DIMETHYLPYRIMIDIN2YL)AMINO)2((1H124TRIAZOL5YLSULFONYL)AMINO)1AZAVINYLOXY)ACETATE
ETHYL2((N(46DIMETHYLPYRIMIDIN2YL)N(1H124TRIAZOL5YLSULFONYL)CARBAMIMIDOYL)AMINO)OXYACETATE
InChI=1SC13H18N8O5Sc142510(22)6262012(1811168(2)59(3)1711)2127(2324)13147151913h57H46H213H3(H141519)(H21617182021)
MFCD01820816
ZINC000008857456
ZINC8857456
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