Vitas-M small molecule compound
7-ethyl-2-{5-[(2,4,6-trichlorophenoxy)methyl]furan-2-yl}-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STK332773
SMILES CCN1CCc2c(C1)sc1c2C(=O)NC(N1)c1ccc(o1)COc1c(Cl)cc(cc1Cl)Cl
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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 C22H20Cl3N3O3S MW 512.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20Cl3N3O3S/c1-2-28-6-5-13-17(9-28)32-22-18(13)21(29)26-20(27-22)16-4-3-12(31-16)10-30-19-14(24)7-11(23)8-15(19)25/h3-4,7-8,20,27H,2,5-6,9-10H2,1H3,(H,26,29)InChIKey
JHQUZZVMMXLZMZ-UHFFFAOYSA-NSynonyms
7ethyl2(5((246trichlorophenoxy)methyl)furan2yl)123568hexahydropyrido(23)thieno(24d)pyrimidin4one
7ethyl2(5((246trichlorophenoxy)methyl)furan2yl)235678hexahydropyrido(4345)thieno(23d)pyrimidin4(1H)one
CCN1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=C(O4)COC5=C(C=C(C=C5Cl)Cl)Cl
InChI=1SC22H20Cl3N3O3Sc1228651317(928)322218(13)21(29)2620(2722)164312(3116)10301914(24)711(23)815(19)25h34782027H256910H21H3(H2629)
MFCD03465496
ZINC000002735936
ZINC000018195280
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