Vitas-M small molecule compound
1-(ethylsulfanyl)-4-(4-methylphenyl)-7,8,9,10-tetrahydro-6H-cyclohepta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK525668
SMILES CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CCCCC3
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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/c1-3-27-21-23-22-20-24(14-11-9-13(2)10-12-14)18(26)17-15-7-5-4-6-8-16(15)28-19(17)25(20)21/h9-12H,3-8H2,1-2H3InChIKey
BFXROHVQXMNUFY-UHFFFAOYSA-NSynonyms
374548-98-81(ethylsulfanyl)4(4methylphenyl)78910tetrahydro6Hcyclohepta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(ethylthio)4(ptolyl)78910tetrahydro4Hcyclohepta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(6H)one
374548988
CCSC1=NN=C2N1C3=C(C4=C(S3)CCCCC4)C(=O)N2C5=CC=C(C=C5)C
InChI=1SC21H22N4OS2c13272123222024(1411913(2)101214)18(26)17157546816(15)2819(17)25(20)21h912H38H212H3
MFCD01957154
ZINC000004824876
ZINC04824876
ZINC4824876
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