Vitas-M small molecule compound
8-methyl-4-(4-methylphenyl)-1-[(2-oxo-2-phenylethyl)sulfanyl]-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
STK531851
SMILES CN1CCc2c(C1)sc1c2c(=O)n(c2n1c(SCC(=O)c1ccccc1)nn2)c1ccc(cc1)C
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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 C26H23N5O2S2 MW 501.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N5O2S2/c1-16-8-10-18(11-9-16)30-23(33)22-19-12-13-29(2)14-21(19)35-24(22)31-25(30)27-28-26(31)34-15-20(32)17-6-4-3-5-7-17/h3-11H,12-15H2,1-2H3InChIKey
YUJMYMLDPYOMAW-UHFFFAOYSA-NSynonyms
8methyl1((2oxo2phenylethyl)thio)4(ptolyl)6789tetrahydropyrido(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
8methyl4(4methylphenyl)1((2oxo2phenylethyl)sulfanyl)6789tetrahydropyrido(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1=CC=C(C=C1)N2C(=O)C3=C(N4C2=NN=C4SCC(=O)C5=CC=CC=C5)SC6=C3CCN(C6)C
InChI=1SC26H23N5O2S2c11681018(11916)3023(33)2219121329(2)1421(19)3524(22)3125(30)272826(31)341520(32)176435717h311H1215H212H3
MFCD02992253
ZINC000019997334
ZINC19997334
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