Vitas-M small molecule compound
2-{3-chloro-5-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]phenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK004855
SMILES COc1cc(cc(c1OCCOc1ccccc1OC)Cl)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 C26H25ClN2O5S MW 513.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25ClN2O5S/c1-31-18-8-4-5-9-19(18)33-11-12-34-23-17(27)13-15(14-20(23)32-2)24-28-25(30)22-16-7-3-6-10-21(16)35-26(22)29-24/h4-5,8-9,13-14H,3,6-7,10-12H2,1-2H3,(H,28,29,30)InChIKey
MLEJZYGORRWQRA-UHFFFAOYSA-NSynonyms
2(3chloro5methoxy4(2(2methoxyphenoxy)ethoxy)phenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(3chloro5methoxy4(2(2methoxyphenoxy)ethoxy)phenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
2(3chloro5methoxy4(2(2methoxyphenoxy)ethoxy)phenyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
COC1=CC=CC=C1OCCOC2=C(C=C(C=C2Cl)C3=NC4=C(C5=C(S4)CCCC5)C(=O)N3)OC
COc1cc(cc(c1OCCOc1ccccc1OC)Cl)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC26H25ClN2O5Sc13118845919(18)331112342317(27)1315(1420(23)322)242825(30)22167361021(16)3526(22)2924h45891314H3671012H212H3(H282930)
MFCD02242629
STK004855
ZINC000008837917
ZINC08837917
ZINC8837917
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