Vitas-M small molecule compound
2-{3-ethoxy-4-[2-(phenylsulfanyl)ethoxy]phenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK014543
SMILES CCOc1cc(ccc1OCCSc1ccccc1)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 C26H26N2O3S2 MW 478.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O3S2/c1-2-30-21-16-17(12-13-20(21)31-14-15-32-18-8-4-3-5-9-18)24-27-25(29)23-19-10-6-7-11-22(19)33-26(23)28-24/h3-5,8-9,12-13,16H,2,6-7,10-11,14-15H2,1H3,(H,27,28,29)InChIKey
NCPHTEVOXFQXLD-UHFFFAOYSA-NSynonyms
2(3ethoxy4(2(phenylsulfanyl)ethoxy)phenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(3ethoxy4(2phenylsulfanylethoxy)phenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
CCOC1=C(C=CC(=C1)C2=NC3=C(C4=C(S3)CCCC4)C(=O)N2)OCCSC5=CC=CC=C5
CCOc1cc(ccc1OCCSc1ccccc1)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC26H26N2O3S2c1230211617(121320(21)31141532188435918)242725(29)231910671122(19)3326(23)2824h3589121316H26710111415H21H3(H272829)
MFCD05977316
STK014543
ZINC000008984111
ZINC08984111
ZINC8984111
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