Vitas-M small molecule compound
ethyl 4-[6-ethyl-2-(ethylsulfanyl)-6-methyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]piperazine-1-carboxylate
Catalog ID
STL343997
SMILES CCOC(=O)N1CCN(CC1)c1nc(SCC)nc2c1c1CC(C)(CC)OCc1s2
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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 C21H30N4O3S2 MW 450.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N4O3S2/c1-5-21(4)12-14-15(13-28-21)30-18-16(14)17(22-19(23-18)29-7-3)24-8-10-25(11-9-24)20(26)27-6-2/h5-13H2,1-4H3InChIKey
JLJTVNGPPMFJRD-UHFFFAOYSA-NSynonyms
846026-93-5846026935
CCC1(CC2=C(CO1)SC3=NC(=NC(=C23)N4CCN(CC4)C(=O)OCC)SCC)C
ethyl4(6ethyl2(ethylsulfanyl)6methyl58dihydro6Hpyrano(4345)thieno(23d)pyrimidin4yl)piperazine1carboxylate
ethyl4(6ethyl2(ethylthio)6methyl68dihydro5Hpyrano(4345)thieno(23d)pyrimidin4yl)piperazine1carboxylate
ethyl4(6ethyl2ethylsulfanyl6methyl58dihydropyrano(45)thieno(12c)pyrimidin4yl)piperazine1carboxylate
InChI=1SC21H30N4O3S2c1521(4)121415(132821)301816(14)17(2219(2318)2973)2481025(11924)20(26)2762h513H214H3
MFCD04172103
ZINC000002420465
ZINC000002420466
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