Vitas-M small molecule compound
ethyl {[4-oxo-3-phenyl-7-(2-phenylethyl)-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetyl carbonate
Catalog ID
STK057633
SMILES CCOC(=O)OC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCN(C3)CCc1ccccc1
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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 C28H27N3O5S2 MW 549.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O5S2/c1-2-35-28(34)36-23(32)18-37-27-29-25-24(26(33)31(27)20-11-7-4-8-12-20)21-14-16-30(17-22(21)38-25)15-13-19-9-5-3-6-10-19/h3-12H,2,13-18H2,1H3InChIKey
GDGRLLJGVBLIAF-UHFFFAOYSA-NSynonyms
CCOC(=O)OC(=O)CSC1=NC2=C(C3=C(S2)CN(CC3)CCC4=CC=CC=C4)C(=O)N1C5=CC=CC=C5
CCOC(=O)OC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCN(C3)CCc1ccccc1
ethoxycarbonyl2((4oxo3phenyl7(2phenylethyl)68dihydro5Hpyrido(23)thieno(24b)pyrimidin2yl)sulfanyl)acetate
ethyl((4oxo3phenyl7(2phenylethyl)345678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetylcarbonate
InChI=1SC28H27N3O5S2c123528(34)3623(32)183727292524(26(33)31(27)20117481220)21141630(1722(21)3825)15131995361019h312H21318H21H3
MFCD01565579
STK057633
ZINC000098045025
ZINC98045025
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