Vitas-M small molecule compound
1,1'-(11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine-3,7-diyldisulfanediyl)bis[3-(4-chlorophenyl)propan-2-one]
Catalog ID
STK934127
SMILES O=C(Cc1ccc(cc1)Cl)CSc1nnc2n1c1sc3c(c1c1n2c(SCC(=O)Cc2ccc(cc2)Cl)nn1)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 C29H22Cl2N6O2S3 MW 653.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22Cl2N6O2S3/c30-18-8-4-16(5-9-18)12-20(38)14-40-28-34-32-25-24-22-2-1-3-23(22)42-26(24)37-27(36(25)28)33-35-29(37)41-15-21(39)13-17-6-10-19(31)11-7-17/h4-11H,1-3,12-15H2InChIKey
PMFRXYIHFYUSLJ-UHFFFAOYSA-NSynonyms
11(1112dihydro10Hcyclopenta(45)thieno(32e)bis(124)triazolo(43a43c)pyrimidine37diyldisulfanediyl)bis(3(4chlorophenyl)propan2one)
33((1112dihydro10Hcyclopenta(45)thieno(32e)bis((124)triazolo)(43a43c)pyrimidine37diyl)bis(sulfanediyl))bis(1(4chlorophenyl)propan2one)
C1CC2=C(C1)SC3=C2C4=NN=C(N4C5=NN=C(N35)SCC(=O)CC6=CC=C(C=C6)Cl)SCC(=O)CC7=CC=C(C=C7)Cl
InChI=1SC29H22Cl2N6O2S3c30188416(5918)1220(38)144028343225242221323(22)4226(24)3727(36(25)28)333529(37)411521(39)131761019(31)11717h411H131215H2
MFCD04077638
ZINC000150404499
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