Vitas-M small molecule compound
1-[(3-methylbutyl)sulfanyl]-4-(4-methylphenyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK332289
SMILES CC(CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CCC3)C
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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 C22H24N4OS2 MW 424.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4OS2/c1-13(2)11-12-28-22-24-23-21-25(15-9-7-14(3)8-10-15)19(27)18-16-5-4-6-17(16)29-20(18)26(21)22/h7-10,13H,4-6,11-12H2,1-3H3InChIKey
LPYCYUGJMOTTPG-UHFFFAOYSA-NSynonyms
1((3methylbutyl)sulfanyl)4(4methylphenyl)78dihydro6Hcyclopenta(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC1=CC=C(C=C1)N2C(=O)C3=C(N4C2=NN=C4SCCC(C)C)SC5=C3CCC5
InChI=1SC22H24N4OS2c113(2)1112282224232125(159714(3)81015)19(27)181654617(16)2920(18)26(21)22h71013H461112H213H3
MFCD03447283
ZINC000002996672
ZINC02996672
ZINC2996672
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