Vitas-M small molecule compound
methyl 5-[(4,6-dihydroxy-2-{[(4-methylphenyl)sulfonyl]amino}pyrimidin-5-yl)methyl]-2-methoxybenzoate
Catalog ID
STL323846
SMILES COC(=O)c1cc(ccc1OC)Cc1c(O)nc(nc1O)NS(=O)(=O)c1ccc(cc1)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 C21H21N3O7S MW 459.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O7S/c1-12-4-7-14(8-5-12)32(28,29)24-21-22-18(25)16(19(26)23-21)11-13-6-9-17(30-2)15(10-13)20(27)31-3/h4-10H,11H2,1-3H3,(H3,22,23,24,25,26)InChIKey
FUSGNKCQYLVVLF-UHFFFAOYSA-NSynonyms
83521-47-583521475
CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=C(C(=O)N2)CC3=CC(=C(C=C3)OC)C(=O)OC)O
InChI=1SC21H21N3O7Sc1124714(8512)32(2829)24212218(25)16(19(26)2321)11136917(302)15(1013)20(27)313h410H11H213H3(H32223242526)
methyl5((46dihydroxy2(((4methylphenyl)sulfonyl)amino)pyrimidin5yl)methyl)2methoxybenzoate
methyl5((46dihydroxy2(4methylphenylsulfonamido)pyrimidin5yl)methyl)2methoxybenzoate
methyl5((4hydroxy2((4methylphenyl)sulfonylamino)6oxo1Hpyrimidin5yl)methyl)2methoxybenzoate
MFCD00571408
ZINC000012320968
ZINC12320968
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