Vitas-M small molecule compound
8-benzyl-4-(3-methylphenyl)-1-(methylsulfanyl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK542960
SMILES CSc1nnc2n1c1sc3c(c1c(=O)n2c1cccc(c1)C)CCN(C3)Cc1ccccc1
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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 C25H23N5OS2 MW 473.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5OS2/c1-16-7-6-10-18(13-16)29-22(31)21-19-11-12-28(14-17-8-4-3-5-9-17)15-20(19)33-23(21)30-24(29)26-27-25(30)32-2/h3-10,13H,11-12,14-15H2,1-2H3InChIKey
ZXRQQPFDEXGVIH-UHFFFAOYSA-NSynonyms
488802-11-5488802115
8benzyl1(methylthio)4(mtolyl)6789tetrahydropyrido(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
8benzyl4(3methylphenyl)1(methylsulfanyl)6789tetrahydropyrido(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1=CC(=CC=C1)N2C(=O)C3=C(N4C2=NN=C4SC)SC5=C3CCN(C5)CC6=CC=CC=C6
InChI=1SC25H23N5OS2c116761018(1316)2922(31)2119111228(14178435917)1520(19)3323(21)3024(29)262725(30)322h31013H11121415H212H3
MFCD03293070
ZINC000020079813
ZINC20079813
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