Vitas-M small molecule compound
4-bromo-2-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)phenyl 4-bromobenzoate
Catalog ID
STK384812
SMILES CC1CCc2c(C1)sc1c2C(=NC(N1)c1cc(Br)ccc1OC(=O)c1ccc(cc1)Br)O
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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 C24H20Br2N2O3S MW 576.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20Br2N2O3S/c1-12-2-8-16-19(10-12)32-23-20(16)22(29)27-21(28-23)17-11-15(26)7-9-18(17)31-24(30)13-3-5-14(25)6-4-13/h3-7,9,11-12,21,28H,2,8,10H2,1H3,(H,27,29)InChIKey
OATHHBJZNPAWNN-UHFFFAOYSA-NSynonyms
(4bromo2(7methyl4oxo235678hexahydro1H(1)benzothiolo(23d)pyrimidin2yl)phenyl)4bromobenzoate
4bromo2(4hydroxy7methyl125678hexahydro(1)benzothieno(23d)pyrimidin2yl)phenyl4bromobenzoate
CC1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=C(C=CC(=C4)Br)OC(=O)C5=CC=C(C=C5)Br
InChI=1SC24H20Br2N2O3Sc112281619(1012)322320(16)22(29)2721(2823)171115(26)7918(17)3124(30)133514(25)6413h37911122128H2810H21H3(H2729)
MFCD11853276
ZINC000101321612
ZINC000101321618
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