Vitas-M small molecule compound
1-(heptylsulfanyl)-4-(2-methylphenyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK532132
SMILES CCCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1C)CCCC3
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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 C25H30N4OS2 MW 466.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4OS2/c1-3-4-5-6-11-16-31-25-27-26-24-28(19-14-9-7-12-17(19)2)22(30)21-18-13-8-10-15-20(18)32-23(21)29(24)25/h7,9,12,14H,3-6,8,10-11,13,15-16H2,1-2H3InChIKey
AKLFUOIDMMPKDO-UHFFFAOYSA-NSynonyms
1(heptylsulfanyl)4(2methylphenyl)6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(heptylthio)4(otolyl)6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CCCCCCCSC1=NN=C2N1C3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=CC=C5C
InChI=1SC25H30N4OS2c134561116312527262428(1914971217(19)2)22(30)2118138101520(18)3223(21)29(24)25h791214H3681011131516H212H3
MFCD02989357
ZINC000097951092
ZINC97951092
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