Vitas-M small molecule compound
4-(2-methoxyphenyl)-1-[(2-oxo-2-phenylethyl)sulfanyl]-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK830897
SMILES COc1ccccc1n1c2nnc(n2c2c(c1=O)c1CCCc1s2)SCC(=O)c1ccccc1
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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 C25H20N4O3S2 MW 488.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N4O3S2/c1-32-19-12-6-5-11-17(19)28-22(31)21-16-10-7-13-20(16)34-23(21)29-24(28)26-27-25(29)33-14-18(30)15-8-3-2-4-9-15/h2-6,8-9,11-12H,7,10,13-14H2,1H3InChIKey
SOHPNWUOZRJZGO-UHFFFAOYSA-NSynonyms
4(2methoxyphenyl)1((2oxo2phenylethyl)sulfanyl)78dihydro6Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4(2methoxyphenyl)1((2oxo2phenylethyl)thio)78dihydro4Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(6H)one
COC1=CC=CC=C1N2C(=O)C3=C(N4C2=NN=C4SCC(=O)C5=CC=CC=C5)SC6=C3CCC6
InChI=1SC25H20N4O3S2c1321912651117(19)2822(31)21161071320(16)3423(21)2924(28)262725(29)331418(30)158324915h26891112H7101314H21H3
MFCD02236104
ZINC000000986157
ZINC00986157
ZINC986157
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