Vitas-M small molecule compound
methyl 4,5-dimethoxy-2-[({5-[4-(methylsulfonyl)phenyl]-2H-tetrazol-2-yl}acetyl)amino]benzoate
Catalog ID
STK776737
SMILES COC(=O)c1cc(OC)c(cc1NC(=O)Cn1nnc(n1)c1ccc(cc1)S(=O)(=O)C)OC
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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 C20H21N5O7S MW 475.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O7S/c1-30-16-9-14(20(27)32-3)15(10-17(16)31-2)21-18(26)11-25-23-19(22-24-25)12-5-7-13(8-6-12)33(4,28)29/h5-10H,11H2,1-4H3,(H,21,26)InChIKey
XGZHGSHPIFPZTP-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CN2N=C(N=N2)C3=CC=C(C=C3)S(=O)(=O)C)OC
InChI=1SC20H21N5O7Sc13016914(20(27)323)15(1017(16)312)2118(26)11252319(222425)125713(8612)33(428)29h510H11H214H3(H2126)
methyl45dimethoxy2(((5(4(methylsulfonyl)phenyl)2Htetrazol2yl)acetyl)amino)benzoate
METHYL45DIMETHOXY2((2(5(4METHYLSULFONYLPHENYL)TETRAZOL2YL)ACETYL)AMINO)BENZOATE
MFCD05259419
ZINC000012418166
ZINC12418166
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