Vitas-M small molecule compound
1-(ethylsulfanyl)-6-methyl-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
STK532134
SMILES CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)C(C)CCC3
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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 C21H22N4OS2 MW 410.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4OS2/c1-4-27-21-23-22-20-24(14-10-8-12(2)9-11-14)18(26)17-16-13(3)6-5-7-15(16)28-19(17)25(20)21/h8-11,13H,4-7H2,1-3H3InChIKey
GGYWAJITJQNGRM-UHFFFAOYSA-NSynonyms
1(ethylsulfanyl)6methyl4(4methylphenyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(ethylthio)6methyl4(ptolyl)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CCSC1=NN=C2N1C3=C(C4=C(S3)CCCC4C)C(=O)N2C5=CC=C(C=C5)C
InChI=1SC21H22N4OS2c14272123222024(1410812(2)91114)18(26)171613(3)65715(16)2819(17)25(20)21h81113H47H213H3
MFCD02986631
ZINC000001248975
ZINC000001248976
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