Vitas-M small molecule compound
1-[(4-chlorobenzyl)sulfanyl]-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK720528
SMILES Clc1ccc(cc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCCC3
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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 C24H19ClN4OS2 MW 479.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN4OS2/c25-16-12-10-15(11-13-16)14-31-24-27-26-23-28(17-6-2-1-3-7-17)21(30)20-18-8-4-5-9-19(18)32-22(20)29(23)24/h1-3,6-7,10-13H,4-5,8-9,14H2InChIKey
XHCMMPHJIISHNB-UHFFFAOYSA-NSynonyms
799825-82-41((4chlorobenzyl)sulfanyl)4phenyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1((4chlorobenzyl)thio)4phenyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
799825824
C1CCC2=C(C1)C3=C(S2)N4C(=NN=C4SCC5=CC=C(C=C5)Cl)N(C3=O)C6=CC=CC=C6
InChI=1SC24H19ClN4OS2c2516121015(111316)14312427262328(176213717)21(30)2018845919(18)3222(20)29(23)24h13671013H458914H2
MFCD03683176
ZINC000002239131
ZINC02239131
ZINC2239131
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