Vitas-M small molecule compound
1-[(4-chlorobenzyl)sulfanyl]-4-(4-methylphenyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK720504
SMILES Cc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CCCCc1s2)SCc1ccc(cc1)Cl
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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 C25H21ClN4OS2 MW 493.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN4OS2/c1-15-6-12-18(13-7-15)29-22(31)21-19-4-2-3-5-20(19)33-23(21)30-24(29)27-28-25(30)32-14-16-8-10-17(26)11-9-16/h6-13H,2-5,14H2,1H3InChIKey
FEZXSUIGUUGSOP-UHFFFAOYSA-NSynonyms
836635-62-21((4chlorobenzyl)sulfanyl)4(4methylphenyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1((4chlorobenzyl)thio)4(ptolyl)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
836635622
CC1=CC=C(C=C1)N2C(=O)C3=C(N4C2=NN=C4SCC5=CC=C(C=C5)Cl)SC6=C3CCCC6
InChI=1SC25H21ClN4OS2c11561218(13715)2922(31)2119423520(19)3323(21)3024(29)272825(30)32141681017(26)11916h613H2514H21H3
MFCD03689699
ZINC000009462179
ZINC09462179
ZINC9462179
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