Vitas-M small molecule compound
2-(methylsulfanyl)-7-[4-(methylsulfanyl)phenyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Catalog ID
STK499433
SMILES CSc1ccc(cc1)C1C=C(Nc2n1nc(n2)SC)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 C14H14N4O2S2 MW 334.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N4O2S2/c1-21-9-5-3-8(4-6-9)11-7-10(12(19)20)15-13-16-14(22-2)17-18(11)13/h3-7,11H,1-2H3,(H,19,20)(H,15,16,17)InChIKey
RFLQBYFGRLUKFZ-UHFFFAOYSA-NSynonyms
1081119-52-91081119529
2(methylsulfanyl)7(4(methylsulfanyl)phenyl)47dihydro(124)triazolo(15a)pyrimidine5carboxylicacid
2(methylthio)7(4(methylthio)phenyl)47dihydro(124)triazolo(15a)pyrimidine5carboxylicacid
2methylsulfanyl7(4methylsulfanylphenyl)17dihydro(124)triazolo(15a)pyrimidine5carboxylicacid
CSC1=CC=C(C=C1)C2C=C(N=C3N2NC(=N3)SC)C(=O)O
InChI=1SC14H14N4O2S2c1219538(469)11710(12(19)20)15131614(222)1718(11)13h3711H12H3(H1920)(H151617)
MFCD11855743
ZINC000101446941
ZINC000101446944
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