Vitas-M small molecule compound
pentyl [(3-benzyl-6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Catalog ID
STK074213
SMILES CCCCCOC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)(C)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 C25H30N2O4S2 MW 486.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O4S2/c1-4-5-9-12-30-20(28)16-32-24-26-22-21(18-13-25(2,3)31-15-19(18)33-22)23(29)27(24)14-17-10-7-6-8-11-17/h6-8,10-11H,4-5,9,12-16H2,1-3H3InChIKey
CCPHBVUKVNBOPU-UHFFFAOYSA-NSynonyms
346727-51-3346727513
CCCCCOC(=O)CSC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)N1CC4=CC=CC=C4
CCCCCOC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CC(OC3)(C)C
InChI=1SC25H30N2O4S2c1459123020(28)163224262221(181325(23)311519(18)3322)23(29)27(24)1417107681117h681011H4591216H213H3
MFCD01557202
pentyl((3benzyl66dimethyl4oxo3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetate
pentyl2((3benzyl66dimethyl4oxo4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)acetate
pentyl2((3benzyl66dimethyl4oxo58dihydropyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)acetate
STK074213
ZINC000002183009
ZINC02183009
ZINC2183009
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