Vitas-M small molecule compound
1-[3-(dimethylamino)propyl]-6-(4-methoxyphenyl)-3-(propylsulfanyl)thieno[2,3-d][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Catalog ID
STK937475
SMILES CCCSc1nn(c2n1c(=O)c1c(n2)scc1c1ccc(cc1)OC)CCCN(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 C22H27N5O2S2 MW 457.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O2S2/c1-5-13-30-22-24-26(12-6-11-25(2)3)21-23-19-18(20(28)27(21)22)17(14-31-19)15-7-9-16(29-4)10-8-15/h7-10,14H,5-6,11-13H2,1-4H3InChIKey
QNKOYKJGBNXXSG-UHFFFAOYSA-NSynonyms
1219545-32-01(3(dimethylamino)propyl)6(4methoxyphenyl)3(propylsulfanyl)thieno(23d)(124)triazolo(43a)pyrimidin5(1H)one
1(3(dimethylamino)propyl)6(4methoxyphenyl)3(propylthio)thieno(23d)(124)triazolo(43a)pyrimidin5(1H)one
1219545320
CCCSC1=NN(C2=NC3=C(C(=CS3)C4=CC=C(C=C4)OC)C(=O)N21)CCCN(C)C
InChI=1SC22H27N5O2S2c151330222426(1261125(2)3)21231918(20(28)27(21)22)17(143119)157916(294)10815h71014H561113H214H3
MFCD16626505
ZINC000040286751
ZINC40286751
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