Vitas-M small molecule compound
1-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}-4-propylthieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STL135107
SMILES CCCn1c2nnc(n2c2c(c1=O)scc2)CCCC(=O)N1CCN(CC1)c1ccc(cc1)OC
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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 C25H30N6O3S MW 494.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N6O3S/c1-3-12-30-24(33)23-20(11-17-35-23)31-21(26-27-25(30)31)5-4-6-22(32)29-15-13-28(14-16-29)18-7-9-19(34-2)10-8-18/h7-11,17H,3-6,12-16H2,1-2H3InChIKey
QDIIPCPWNSWAIS-UHFFFAOYSA-NSynonyms
1(4(4(4methoxyphenyl)piperazin1yl)4oxobutyl)4propylthieno(23e)(124)triazolo(43a)pyrimidin5(4H)one
CCCN1C(=O)C2=C(C=CS2)N3C1=NN=C3CCCC(=O)N4CCN(CC4)C5=CC=C(C=C5)OC
InChI=1SC25H30N6O3Sc13123024(33)2320(11173523)3121(262725(30)31)54622(32)29151328(141629)187919(342)10818h71117H361216H212H3
MFCD14902304
ZINC000008596031
ZINC8596031
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