Vitas-M small molecule compound
7-benzyl-2-(6-bromo-1,3-benzodioxol-5-yl)-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STK382337
SMILES O=C1NC(Nc2c1c1CCN(Cc1s2)Cc1ccccc1)c1cc2OCOc2cc1Br
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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 C23H20BrN3O3S MW 498.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20BrN3O3S/c24-16-9-18-17(29-12-30-18)8-15(16)21-25-22(28)20-14-6-7-27(10-13-4-2-1-3-5-13)11-19(14)31-23(20)26-21/h1-5,8-9,21,26H,6-7,10-12H2,(H,25,28)InChIKey
CHSPKWUMJHCYLS-UHFFFAOYSA-NSynonyms
7benzyl2(6bromo13benzodioxol5yl)123568hexahydropyrido(23)thieno(24d)pyrimidin4one
7benzyl2(6bromo13benzodioxol5yl)235678hexahydropyrido(4345)thieno(23d)pyrimidin4(1H)one
C1CN(CC2=C1C3=C(S2)NC(NC3=O)C4=CC5=C(C=C4Br)OCO5)CC6=CC=CC=C6
InChI=1SC23H20BrN3O3Sc241691817(29123018)815(16)212522(28)20146727(10134213513)1119(14)3123(20)2621h15892126H671012H2(H2528)
MFCD02915776
ZINC000015945025
ZINC000015945027
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