Vitas-M small molecule compound
4-benzyl-1-{[2-(4-bromophenyl)-2-oxoethyl]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
STK722427
SMILES Brc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2Cc1ccccc1)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 C25H19BrN4O2S2 MW 551.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19BrN4O2S2/c26-17-11-9-16(10-12-17)19(31)14-33-25-28-27-24-29(13-15-5-2-1-3-6-15)22(32)21-18-7-4-8-20(18)34-23(21)30(24)25/h1-3,5-6,9-12H,4,7-8,13-14H2InChIKey
XKVFTAKZOWQTFB-UHFFFAOYSA-NSynonyms
351006-41-2351006412
4benzyl1((2(4bromophenyl)2oxoethyl)sulfanyl)78dihydro6Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4benzyl1((2(4bromophenyl)2oxoethyl)thio)78dihydro4Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(6H)one
C1CC2=C(C1)SC3=C2C(=O)N(C4=NN=C(N34)SCC(=O)C5=CC=C(C=C5)Br)CC6=CC=CC=C6
InChI=1SC25H19BrN4O2S2c261711916(101217)19(31)14332528272429(13155213615)22(32)211874820(18)3423(21)30(24)25h1356912H4781314H2
MFCD01559084
ZINC000001873309
ZINC01873309
ZINC1873309
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