Vitas-M small molecule compound
8-(heptylsulfanyl)-2,3-dimethyl-5-phenylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one
Catalog ID
STK993135
SMILES CCCCCCCSc1nnc2n1c1sc(c(c1c(=O)n2c1ccccc1)C)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 C22H26N4OS2 MW 426.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4OS2/c1-4-5-6-7-11-14-28-22-24-23-21-25(17-12-9-8-10-13-17)19(27)18-15(2)16(3)29-20(18)26(21)22/h8-10,12-13H,4-7,11,14H2,1-3H3InChIKey
CEKKINHLURETBK-UHFFFAOYSA-NSynonyms
8(heptylsulfanyl)23dimethyl5phenylthieno(32e)(124)triazolo(43a)pyrimidin4(5H)one
CCCCCCCSC1=NN=C2N1C3=C(C(=C(S3)C)C)C(=O)N2C4=CC=CC=C4
InChI=1SC22H26N4OS2c145671114282224232125(171298101317)19(27)1815(2)16(3)2920(18)26(21)22h8101213H471114H213H3
MFCD02631151
ZINC000008432107
ZINC08432107
ZINC8432107
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