Vitas-M small molecule compound
2-{[2-(2,5-dimethylphenoxy)ethyl]sulfanyl}-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK124756
SMILES Cc1ccc(c(c1)OCCSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3)C
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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 C26H26N2O2S2 MW 462.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O2S2/c1-17-12-13-18(2)21(16-17)30-14-15-31-26-27-24-23(20-10-6-7-11-22(20)32-24)25(29)28(26)19-8-4-3-5-9-19/h3-5,8-9,12-13,16H,6-7,10-11,14-15H2,1-2H3InChIKey
OYNGSALURQXSMS-UHFFFAOYSA-NSynonyms
2((2(25dimethylphenoxy)ethyl)sulfanyl)3phenyl5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(2(25dimethylphenoxy)ethylsulfanyl)3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC1=CC(=C(C=C1)C)OCCSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=CC=C5
InChI=1SC26H26N2O2S2c117121318(2)21(1617)3014153126272423(2010671122(20)3224)25(29)28(26)198435919h3589121316H6710111415H212H3
MFCD03216563
ZINC000009833647
ZINC09833647
ZINC9833647
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