Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylic acid
Catalog ID
STK595728
SMILES Cc1cc(C)nc(n1)SCc1c(nnn1c1nonc1N)C(=O)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 C12H12N8O3S MW 348.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N8O3S/c1-5-3-6(2)15-12(14-5)24-4-7-8(11(21)22)16-19-20(7)10-9(13)17-23-18-10/h3H,4H2,1-2H3,(H2,13,17)(H,21,22)InChIKey
WPPRLKZAMJWHLF-UHFFFAOYSA-NSynonyms
879577-29-41(4amino125oxadiazol3yl)5(((46dimethylpyrimidin2yl)sulfanyl)methyl)1H123triazole4carboxylicacid
1(4amino125oxadiazol3yl)5(((46dimethylpyrimidin2yl)thio)methyl)1H123triazole4carboxylicacid
1(4amino125oxadiazol3yl)5((46dimethylpyrimidin2yl)sulfanylmethyl)triazole4carboxylicacid
879577294
CC1=CC(=NC(=N1)SCC2=C(N=NN2C3=NON=C3N)C(=O)O)C
InChI=1SC12H12N8O3Sc1536(2)1512(145)24478(11(21)22)161920(7)109(13)17231810h3H4H212H3(H21317)(H2122)
MFCD07641713
ZINC000008994390
ZINC8994390
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