Vitas-M small molecule compound
2-methyl-7-[4-(methylsulfanyl)phenyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Catalog ID
STK399615
SMILES CSc1ccc(cc1)C1C=C(Nc2n1nc(n2)C)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 C14H14N4O2S MW 302.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N4O2S/c1-8-15-14-16-11(13(19)20)7-12(18(14)17-8)9-3-5-10(21-2)6-4-9/h3-7,12H,1-2H3,(H,19,20)(H,15,16,17)InChIKey
XUUJTJGNQWBTEJ-UHFFFAOYSA-NSynonyms
1030452-79-91030452799
2methyl7(4(methylsulfanyl)phenyl)47dihydro(124)triazolo(15a)pyrimidine5carboxylicacid
2methyl7(4(methylthio)phenyl)47dihydro(124)triazolo(15a)pyrimidine5carboxylicacid
2methyl7(4methylsulfanylphenyl)17dihydro(124)triazolo(15a)pyrimidine5carboxylicacid
CC1=NC2=NC(=CC(N2N1)C3=CC=C(C=C3)SC)C(=O)O
InChI=1SC14H14N4O2Sc1815141611(13(19)20)712(18(14)178)93510(212)649h3712H12H3(H1920)(H151617)
MFCD11082386
ZINC000019962469
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