Vitas-M small molecule compound
4-(3-chlorophenyl)-8-methyl-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
STK580598
SMILES CN1CCc2c(C1)sc1c2c(=O)n(c2n1c(SCC(=O)c1ccccc1)nn2)c1cccc(c1)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 C25H20ClN5O2S2 MW 522.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClN5O2S2/c1-29-11-10-18-20(13-29)35-23-21(18)22(33)30(17-9-5-8-16(26)12-17)24-27-28-25(31(23)24)34-14-19(32)15-6-3-2-4-7-15/h2-9,12H,10-11,13-14H2,1H3InChIKey
XXTLMESURNNEDH-UHFFFAOYSA-NSynonyms
848866-75-14(3chlorophenyl)8methyl1((2oxo2phenylethyl)sulfanyl)6789tetrahydropyrido(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
4(3chlorophenyl)8methyl1((2oxo2phenylethyl)thio)6789tetrahydropyrido(4345)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
848866751
CN1CCC2=C(C1)SC3=C2C(=O)N(C4=NN=C(N34)SCC(=O)C5=CC=CC=C5)C6=CC(=CC=C6)Cl
InChI=1SC25H20ClN5O2S2c12911101820(1329)352321(18)22(33)30(1795816(26)1217)24272825(31(23)24)341419(32)156324715h2912H10111314H21H3
MFCD04197069
ZINC000097954837
ZINC97954837
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