Vitas-M small molecule compound
2-{[5-(benzylsulfanyl)-9,10-dihydro-8H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Catalog ID
STK720431
SMILES CCOc1ccc(cc1)NC(=O)CSc1nnc2n1c(SCc1ccccc1)nc1c2c2CCCc2s1
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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 C27H25N5O2S3 MW 547.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O2S3/c1-2-34-19-13-11-18(12-14-19)28-22(33)16-36-27-31-30-24-23-20-9-6-10-21(20)37-25(23)29-26(32(24)27)35-15-17-7-4-3-5-8-17/h3-5,7-8,11-14H,2,6,9-10,15-16H2,1H3,(H,28,33)InChIKey
SFLWZQNSAXAFFK-UHFFFAOYSA-NSynonyms
577763-12-32((5(benzylsulfanyl)910dihydro8Hcyclopenta(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)N(4ethoxyphenyl)acetamide
2((5(benzylthio)910dihydro8Hcyclopenta(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)N(4ethoxyphenyl)acetamide
577763123
CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C3N2C(=NC4=C3C5=C(S4)CCC5)SCC6=CC=CC=C6
InChI=1SC27H25N5O2S3c123419131118(121419)2822(33)1636273130242320961021(20)3725(23)2926(32(24)27)3515177435817h35781114H269101516H21H3(H2833)
MFCD04018661
ZINC000097953079
ZINC97953079
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