Vitas-M small molecule compound
5-amino-1-(4-{[(6-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)sulfonyl]amino}phenyl)-1H-1,2,3-triazole-4-carboxylic acid
Catalog ID
STL442060
SMILES OC(=O)c1nnn(c1N)c1ccc(cc1)NS(=O)(=O)c1c(C)[nH]c(=O)[nH]c1=O
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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 C14H13N7O6S MW 407.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13N7O6S/c1-6-10(12(22)17-14(25)16-6)28(26,27)19-7-2-4-8(5-3-7)21-11(15)9(13(23)24)18-20-21/h2-5,19H,15H2,1H3,(H,23,24)(H2,16,17,22,25)InChIKey
BYWXAHGJHOPMNG-UHFFFAOYSA-NSynonyms
5amino1(4(((6methyl24dioxo1234tetrahydropyrimidin5yl)sulfonyl)amino)phenyl)1H123triazole4carboxylicacid
5amino1(4((6methyl24dioxo1Hpyrimidin5yl)sulfonylamino)phenyl)triazole4carboxylicacid
CC1=C(C(=O)NC(=O)N1)S(=O)(=O)NC2=CC=C(C=C2)N3C(=C(N=N3)C(=O)O)N
InChI=1SC14H13N7O6Sc1610(12(22)1714(25)166)28(2627)197248(537)2111(15)9(13(23)24)182021h2519H15H21H3(H2324)(H216172225)
MFCD09992784
OC(=O)c1nnn(c1N)c1ccc(cc1)NS(=O)(=O)c1c(C)(nH)c(=O)(nH)c1=O
ZINC000033435972
ZINC33435972
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