Vitas-M small molecule compound
6-(2-oxo-2-phenylethyl)-2-(pyridin-3-yl)-6,8,9,10-tetrahydro-5H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-one
Catalog ID
STK943548
SMILES O=C(c1ccccc1)Cn1c2sc3c(c2c2n(c1=O)nc(n2)c1cccnc1)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 C23H17N5O2S MW 427.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N5O2S/c29-17(14-6-2-1-3-7-14)13-27-22-19(16-9-4-10-18(16)31-22)21-25-20(26-28(21)23(27)30)15-8-5-11-24-12-15/h1-3,5-8,11-12H,4,9-10,13H2InChIKey
KBHUNWJYUYNHLI-UHFFFAOYSA-NSynonyms
951931-40-16(2oxo2phenylethyl)2(pyridin3yl)68910tetrahydro5Hcyclopenta(45)thieno(32e)(124)triazolo(15c)pyrimidin5one
951931401
C1CC2=C(C1)SC3=C2C4=NC(=NN4C(=O)N3CC(=O)C5=CC=CC=C5)C6=CN=CC=C6
InChI=1SC23H17N5O2Sc2917(146213714)13272219(16941018(16)3122)212520(2628(21)23(27)30)158511241215h13581112H491013H2
MFCD09856300
ZINC000013725827
ZINC13725827
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