Vitas-M small molecule compound
2-(3,5-dibromo-4-methoxyphenyl)-7-methyl-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one
Catalog ID
STK746412
SMILES COc1c(Br)cc(cc1Br)C1NC(=O)c2c(N1)sc1c2CCN(C1)C
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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 C17H17Br2N3O2S MW 487.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17Br2N3O2S/c1-22-4-3-9-12(7-22)25-17-13(9)16(23)20-15(21-17)8-5-10(18)14(24-2)11(19)6-8/h5-6,15,21H,3-4,7H2,1-2H3,(H,20,23)InChIKey
PLOYHUSTYYBLJO-UHFFFAOYSA-NSynonyms
439127-57-82(35dibromo4methoxyphenyl)7methyl123568hexahydropyrido(23)thieno(24d)pyrimidin4one
2(35dibromo4methoxyphenyl)7methyl235678hexahydropyrido(4345)thieno(23d)pyrimidin4(1H)one
439127578
CN1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC(=C(C(=C4)Br)OC)Br
InChI=1SC17H17Br2N3O2Sc12243912(722)251713(9)16(23)2015(2117)8510(18)14(242)11(19)68h561521H347H212H3(H2023)
MFCD02173968
ZINC000008429897
ZINC000008429898
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