Vitas-M small molecule compound
methyl [(3-cyclohexyl-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
STK014659
SMILES COC(=O)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)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 C20H26N2O4S2 MW 422.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N2O4S2/c1-20(2)9-13-14(10-26-20)28-17-16(13)18(24)22(12-7-5-4-6-8-12)19(21-17)27-11-15(23)25-3/h12H,4-11H2,1-3H3InChIKey
KKLWCNLRUOTXKV-UHFFFAOYSA-NSynonyms
351006-89-8351006898
CC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC(=O)OC)C4CCCCC4)C
COC(=O)CSc1nc2sc3c(c2c(=O)n1C1CCCCC1)CC(OC3)(C)C
InChI=1SC20H26N2O4S2c120(2)91314(102620)281716(13)18(24)22(127546812)19(2117)271115(23)253h12H411H213H3
methyl((3cyclohexyl66dimethyl4oxo3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetate
methyl2((3cyclohexyl66dimethyl4oxo4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)acetate
methyl2((3cyclohexyl66dimethyl4oxo58dihydropyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)acetate
MFCD01565686
STK014659
ZINC000000752725
ZINC00752725
ZINC752725
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