Vitas-M small molecule compound
ethyl 2-[(6-ethyl-6-methyl-4-oxo-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]propanoate
Catalog ID
STL328887
SMILES CCOC(=O)C(Sc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)CC)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 C23H26N2O4S2 MW 458.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O4S2/c1-5-23(4)12-16-17(13-29-23)31-19-18(16)20(26)25(15-10-8-7-9-11-15)22(24-19)30-14(3)21(27)28-6-2/h7-11,14H,5-6,12-13H2,1-4H3InChIKey
KMNGXOSBPZQHAD-UHFFFAOYSA-NSynonyms
CCC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SC(C)C(=O)OCC)C4=CC=CC=C4)C
ethyl2((6ethyl6methyl4oxo3phenyl3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)propanoate
ethyl2((6ethyl6methyl4oxo3phenyl4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)propanoate
ethyl2((6ethyl6methyl4oxo3phenyl58dihydropyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)propanoate
InChI=1SC23H26N2O4S2c1523(4)121617(132923)311918(16)20(26)25(15108791115)22(2419)3014(3)21(27)2862h71114H561213H214H3
MFCD02237798
ZINC000002295957
ZINC000002295960
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