Vitas-M small molecule compound
2-{4-[2-(4-bromophenoxy)ethoxy]-3-ethoxyphenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK084836
SMILES CCOc1cc(ccc1OCCOc1ccc(cc1)Br)c1nc2sc3c(c2c(=O)[nH]1)CCCC3
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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 C26H25BrN2O4S MW 541.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25BrN2O4S/c1-2-31-21-15-16(7-12-20(21)33-14-13-32-18-10-8-17(27)9-11-18)24-28-25(30)23-19-5-3-4-6-22(19)34-26(23)29-24/h7-12,15H,2-6,13-14H2,1H3,(H,28,29,30)InChIKey
WRWKZPXIFAJMCO-UHFFFAOYSA-NSynonyms
5823-85-82(4(2(4bromophenoxy)ethoxy)3ethoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(4(2(4bromophenoxy)ethoxy)3ethoxyphenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
5823858
CCOC1=C(C=CC(=C1)C2=NC3=C(C4=C(S3)CCCC4)C(=O)N2)OCCOC5=CC=C(C=C5)Br
CCOc1cc(ccc1OCCOc1ccc(cc1)Br)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC26H25BrN2O4Sc1231211516(71220(21)331413321810817(27)91118)242825(30)2319534622(19)3426(23)2924h71215H261314H21H3(H282930)
MFCD03183970
STK084836
ZINC000100271212
ZINC100271212
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