Vitas-M small molecule compound
2-(3,5-dibromo-4-methoxyphenyl)-7-methyl-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Catalog ID
STK384875
SMILES COc1c(Br)cc(cc1Br)C1N=C(O)c2c(N1)sc1c2CCC(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 C18H18Br2N2O2S MW 486.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18Br2N2O2S/c1-8-3-4-10-13(5-8)25-18-14(10)17(23)21-16(22-18)9-6-11(19)15(24-2)12(20)7-9/h6-8,16,22H,3-5H2,1-2H3,(H,21,23)InChIKey
ODZISSJIPTWNRT-UHFFFAOYSA-NSynonyms
2(35dibromo4methoxyphenyl)7methyl125678hexahydro(1)benzothieno(23d)pyrimidin4ol
2(35dibromo4methoxyphenyl)7methyl235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC(=C(C(=C4)Br)OC)Br
InChI=1SC18H18Br2N2O2Sc18341013(58)251814(10)17(23)2116(2218)9611(19)15(242)12(20)79h681622H35H212H3(H2123)
MFCD11853339
ZINC000015947734
ZINC000015947740
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