Vitas-M small molecule compound
2-{4-[(2,4-dichlorobenzyl)oxy]-3-ethoxyphenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ol
Catalog ID
STL046040
SMILES CCOc1cc(ccc1OCc1ccc(cc1Cl)Cl)c1nc(O)c2c(n1)sc1c2CCCC1
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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 C25H22Cl2N2O3S MW 501.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22Cl2N2O3S/c1-2-31-20-11-14(8-10-19(20)32-13-15-7-9-16(26)12-18(15)27)23-28-24(30)22-17-5-3-4-6-21(17)33-25(22)29-23/h7-12H,2-6,13H2,1H3,(H,28,29,30)InChIKey
ZHLFNHAFJOIHAF-UHFFFAOYSA-NSynonyms
2(4((24dichlorobenzyl)oxy)3ethoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4ol
2(4((24dichlorophenyl)methoxy)3ethoxyphenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
CCOC1=C(C=CC(=C1)C2=NC3=C(C4=C(S3)CCCC4)C(=O)N2)OCC5=C(C=C(C=C5)Cl)Cl
InChI=1SC25H22Cl2N2O3Sc1231201114(81019(20)3213157916(26)1218(15)27)232824(30)2217534621(17)3325(22)2923h712H2613H21H3(H282930)
MFCD03798602
ZINC000008836653
ZINC08836653
ZINC8836653
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