Vitas-M small molecule compound
1-{4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxobutyl}-4-methylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STL135082
SMILES Clc1cccc(c1)N1CCN(CC1)C(=O)CCCc1nnc2n1c1ccsc1c(=O)n2C
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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 C22H23ClN6O2S MW 470.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN6O2S/c1-26-21(31)20-17(8-13-32-20)29-18(24-25-22(26)29)6-3-7-19(30)28-11-9-27(10-12-28)16-5-2-4-15(23)14-16/h2,4-5,8,13-14H,3,6-7,9-12H2,1H3InChIKey
KPHBQSLHSMRMFK-UHFFFAOYSA-NSynonyms
887223-37-21(4(4(3chlorophenyl)piperazin1yl)4oxobutyl)4methylthieno(23e)(124)triazolo(43a)pyrimidin5(4H)one
887223372
CN1C(=O)C2=C(C=CS2)N3C1=NN=C3CCCC(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl
InChI=1SC22H23ClN6O2Sc12621(31)2017(8133220)2918(242522(26)29)63719(30)2811927(101228)1652415(23)1416h24581314H367912H21H3
MFCD06743805
ZINC000009118923
ZINC09118923
ZINC9118923
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