Vitas-M small molecule compound
3-[5-methyl-2-(methylsulfanyl)-7-oxo-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]propanoic acid
Catalog ID
STL361556
SMILES CSc1nn2c(n1)[nH]c(c(c2=O)CCC(=O)O)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 C10H12N4O3S MW 268.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H12N4O3S/c1-5-6(3-4-7(15)16)8(17)14-9(11-5)12-10(13-14)18-2/h3-4H2,1-2H3,(H,15,16)(H,11,12,13)InChIKey
SRXXIVHGCAQCEX-UHFFFAOYSA-NSynonyms
3(5METHYL2(METHYLSULFANYL)7OXO47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN6YL)PROPANOICACID
3(5methyl2methylsulfanyl7oxo1H(124)triazolo(15a)pyrimidin6yl)propanoicacid
3(5METHYL2METHYLTHIO7OXO48DIHYDRO124TRIAZOLO(15A)PYRIMIDIN6YL)PROPANOICACID
CC1=C(C(=O)N2C(=N1)N=C(N2)SC)CCC(=O)O
CSc1nn2c(n1)(nH)c(c(c2=O)CCC(=O)O)C
InChI=1SC10H12N4O3Sc156(347(15)16)8(17)149(115)1210(1314)182h34H212H3(H1516)(H111213)
ZINC20153774
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