Vitas-M small molecule compound
2-{3,5-dichloro-4-[2-(2-methylphenoxy)ethoxy]phenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK023235
SMILES Clc1cc(cc(c1OCCOc1ccccc1C)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 C25H22Cl2N2O3S MW 501.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22Cl2N2O3S/c1-14-6-2-4-8-19(14)31-10-11-32-22-17(26)12-15(13-18(22)27)23-28-24(30)21-16-7-3-5-9-20(16)33-25(21)29-23/h2,4,6,8,12-13H,3,5,7,9-11H2,1H3,(H,28,29,30)InChIKey
XSGSBZSSFQYTAD-UHFFFAOYSA-NSynonyms
2(35dichloro4(2(2methylphenoxy)ethoxy)phenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(35dichloro4(2(2methylphenoxy)ethoxy)phenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
CC1=CC=CC=C1OCCOC2=C(C=C(C=C2Cl)C3=NC4=C(C5=C(S4)CCCC5)C(=O)N3)Cl
Clc1cc(cc(c1OCCOc1ccccc1C)Cl)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC25H22Cl2N2O3Sc114624819(14)311011322217(26)1215(1318(22)27)232824(30)2116735920(16)3325(21)2923h24681213H357911H21H3(H282930)
MFCD03183977
STK023235
ZINC000013940503
ZINC13940503
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