Vitas-M small molecule compound
2-{3-[2-(3,4-dimethylphenoxy)ethoxy]phenyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK014003
SMILES Cc1ccc(cc1C)OCCOc1cccc(c1)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 C26H26N2O3S MW 446.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O3S/c1-16-10-11-20(14-17(16)2)31-13-12-30-19-7-5-6-18(15-19)24-27-25(29)23-21-8-3-4-9-22(21)32-26(23)28-24/h5-7,10-11,14-15H,3-4,8-9,12-13H2,1-2H3,(H,27,28,29)InChIKey
CHHYKIUNQXFOOM-UHFFFAOYSA-NSynonyms
2(3(2(34dimethylphenoxy)ethoxy)phenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(3(2(34dimethylphenoxy)ethoxy)phenyl)5678tetrahydro3H(1)benzothiolo(23d)pyrimidin4one
CC1=C(C=C(C=C1)OCCOC2=CC=CC(=C2)C3=NC4=C(C5=C(S4)CCCC5)C(=O)N3)C
Cc1ccc(cc1C)OCCOc1cccc(c1)c1nc2sc3c(c2c(=O)(nH)1)CCCC3
InChI=1SC26H26N2O3Sc116101120(1417(16)2)311312301975618(1519)242725(29)2321834922(21)3226(23)2824h5710111415H34891213H212H3(H272829)
MFCD03183972
STK014003
ZINC000008983997
ZINC08983997
ZINC8983997
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