Vitas-M small molecule compound
1-[(4-methoxybenzyl)sulfanyl]-4-phenyl-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK835456
SMILES COc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)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 C24H20N4O2S2 MW 460.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N4O2S2/c1-30-17-12-10-15(11-13-17)14-31-24-26-25-23-27(16-6-3-2-4-7-16)21(29)20-18-8-5-9-19(18)32-22(20)28(23)24/h2-4,6-7,10-13H,5,8-9,14H2,1H3InChIKey
NNUYESOAVXMSMX-UHFFFAOYSA-NSynonyms
1((4methoxybenzyl)sulfanyl)4phenyl78dihydro6Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1((4methoxybenzyl)thio)4phenyl78dihydro4Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(6H)one
COC1=CC=C(C=C1)CSC2=NN=C3N2C4=C(C5=C(S4)CCC5)C(=O)N3C6=CC=CC=C6
InChI=1SC24H20N4O2S2c13017121015(111317)14312426252327(166324716)21(29)201885919(18)3222(20)28(23)24h24671013H58914H21H3
MFCD02240115
ZINC000009057573
ZINC09057573
ZINC9057573
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