Vitas-M small molecule compound
1-(hexylsulfanyl)-4-(2-methoxyphenyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK531414
SMILES CCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1OC)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 C23H26N4O2S2 MW 454.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O2S2/c1-3-4-5-8-14-30-23-25-24-22-26(16-11-6-7-12-17(16)29-2)20(28)19-15-10-9-13-18(15)31-21(19)27(22)23/h6-7,11-12H,3-5,8-10,13-14H2,1-2H3InChIKey
HCLJQTBQTRUCES-UHFFFAOYSA-NSynonyms
1(hexylsulfanyl)4(2methoxyphenyl)78dihydro6Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
1(hexylthio)4(2methoxyphenyl)78dihydro4Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(6H)one
CCCCCCSC1=NN=C2N1C3=C(C4=C(S3)CCC4)C(=O)N2C5=CC=CC=C5OC
InChI=1SC23H26N4O2S2c1345814302325242226(1611671217(16)292)20(28)19151091318(15)3121(19)27(22)23h671112H358101314H212H3
MFCD02238491
ZINC000002296442
ZINC02296442
ZINC2296442
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