Vitas-M small molecule compound
pentyl {[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Catalog ID
STK993882
SMILES CCCCCOC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)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 C24H28N2O3S2 MW 456.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O3S2/c1-3-4-7-14-29-20(27)15-30-24-25-22-21(18-8-5-6-9-19(18)31-22)23(28)26(24)17-12-10-16(2)11-13-17/h10-13H,3-9,14-15H2,1-2H3InChIKey
MGNLXKXDWBDYCL-UHFFFAOYSA-NSynonyms
CCCCCOC(=O)CSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=C(C=C4)C
InChI=1SC24H28N2O3S2c1347142920(27)153024252221(18856919(18)3122)23(28)26(24)17121016(2)111317h1013H391415H212H3
MFCD01907291
pentyl((3(4methylphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetate
pentyl2((3(4methylphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetate
ZINC000002183436
ZINC02183436
ZINC2183436
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