Vitas-M small molecule compound
N-(2,5-dimethoxyphenyl)-2-[(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STL442658
SMILES COc1ccc(c(c1)NC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3)OC
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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 C26H25N3O4S2 MW 507.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O4S2/c1-32-17-12-13-20(33-2)19(14-17)27-22(30)15-34-26-28-24-23(18-10-6-7-11-21(18)35-24)25(31)29(26)16-8-4-3-5-9-16/h3-5,8-9,12-14H,6-7,10-11,15H2,1-2H3,(H,27,30)InChIKey
WDNBBEHQIYOKSX-UHFFFAOYSA-NSynonyms
COC1=CC(=C(C=C1)OC)NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=CC=C5
InChI=1SC26H25N3O4S2c13217121320(332)19(1417)2722(30)153426282423(1810671121(18)3524)25(31)29(26)168435916h35891214H67101115H212H3(H2730)
MFCD05996441
N(25dimethoxyphenyl)2((4oxo3phenyl345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(25dimethoxyphenyl)2((4oxo3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000001116734
ZINC01116734
ZINC1116734
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