Vitas-M small molecule compound
7-benzyl-2-(2,4,6-tribromo-3-hydroxyphenyl)-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK384753
SMILES OC1=NC(Nc2c1c1CCN(Cc1s2)Cc1ccccc1)c1c(Br)cc(c(c1Br)O)Br
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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 C22H18Br3N3O2S MW 628.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18Br3N3O2S/c23-13-8-14(24)19(29)18(25)17(13)20-26-21(30)16-12-6-7-28(9-11-4-2-1-3-5-11)10-15(12)31-22(16)27-20/h1-5,8,20,27,29H,6-7,9-10H2,(H,26,30)InChIKey
ZTBZIKMHULFZID-UHFFFAOYSA-NSynonyms
7benzyl2(246tribromo3hydroxyphenyl)123568hexahydropyrido(23)thieno(24d)pyrimidin4one
7benzyl2(246tribromo3hydroxyphenyl)125678hexahydropyrido(4345)thieno(23d)pyrimidin4ol
C1CN(CC2=C1C3=C(S2)NC(NC3=O)C4=C(C(=C(C=C4Br)Br)O)Br)CC5=CC=CC=C5
InChI=1SC22H18Br3N3O2Sc2313814(24)19(29)18(25)17(13)202621(30)16126728(9114213511)1015(12)3122(16)2720h158202729H67910H2(H2630)
MFCD05661712
ZINC000150399616
ZINC000150399620
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