Vitas-M small molecule compound
4-(2-methylphenyl)-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
STK722262
SMILES O=C(c1ccccc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1C)CCC3
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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 C25H20N4O2S2 MW 472.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N4O2S2/c1-15-8-5-6-12-18(15)28-22(31)21-17-11-7-13-20(17)33-23(21)29-24(28)26-27-25(29)32-14-19(30)16-9-3-2-4-10-16/h2-6,8-10,12H,7,11,13-14H2,1H3InChIKey
MCUOGXLYFYFDCF-UHFFFAOYSA-NSynonyms
1((2oxo2phenylethyl)thio)4(otolyl)78dihydro4Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(6H)one
4(2methylphenyl)1((2oxo2phenylethyl)sulfanyl)78dihydro6Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1=CC=CC=C1N2C(=O)C3=C(N4C2=NN=C4SCC(=O)C5=CC=CC=C5)SC6=C3CCC6
InChI=1SC25H20N4O2S2c1158561218(15)2822(31)21171171320(17)3323(21)2924(28)262725(29)321419(30)1693241016h2681012H7111314H21H3
MFCD02995864
ZINC000002304175
ZINC02304175
ZINC2304175
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