Vitas-M small molecule compound
2-({[(4-methyl-5-{[(methylsulfonyl)(phenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoic acid
Catalog ID
STL365951
SMILES O=C(Nc1ccccc1C(=O)O)CSc1nnc(n1C)CN(S(=O)(=O)C)c1ccccc1
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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 C20H21N5O5S2 MW 475.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O5S2/c1-24-17(12-25(32(2,29)30)14-8-4-3-5-9-14)22-23-20(24)31-13-18(26)21-16-11-7-6-10-15(16)19(27)28/h3-11H,12-13H2,1-2H3,(H,21,26)(H,27,28)InChIKey
XDECODSTCPUYQZ-UHFFFAOYSA-NSynonyms
2((((4methyl5(((methylsulfonyl)(phenyl)amino)methyl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
2((2((4methyl5((Nmethylsulfonylanilino)methyl)124triazol3yl)sulfanyl)acetyl)amino)benzoicacid
CN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C(=O)O)CN(C3=CC=CC=C3)S(=O)(=O)C
InChI=1SC20H21N5O5S2c12417(1225(32(229)30)148435914)222320(24)311318(26)211611761015(16)19(27)28h311H1213H212H3(H2126)(H2728)
MFCD14833921
ZINC000015019742
ZINC15019742
Check stock
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