Vitas-M small molecule compound
2-{[6,6-dimethyl-2-(propan-2-ylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-1-(piperidin-1-yl)ethanone
Catalog ID
STL343957
SMILES CC(Sc1nc(SCC(=O)N2CCCCC2)c2c(n1)sc1c2CC(OC1)(C)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 C21H29N3O2S3 MW 451.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N3O2S3/c1-13(2)28-20-22-18(27-12-16(25)24-8-6-5-7-9-24)17-14-10-21(3,4)26-11-15(14)29-19(17)23-20/h13H,5-12H2,1-4H3InChIKey
FRDKIUHUNFQPDT-UHFFFAOYSA-NSynonyms
845989-67-52((2(isopropylthio)66dimethyl68dihydro5Hpyrano(4345)thieno(23d)pyrimidin4yl)thio)1(piperidin1yl)ethanone
2((66dimethyl2(propan2ylsulfanyl)58dihydro6Hpyrano(4345)thieno(23d)pyrimidin4yl)sulfanyl)1(piperidin1yl)ethanone
2((66dimethyl2propan2ylsulfanyl58dihydropyrano(23)thieno(24b)pyrimidin4yl)sulfanyl)1piperidin1ylethanone
845989675
CC(C)SC1=NC2=C(C3=C(S2)COC(C3)(C)C)C(=N1)SCC(=O)N4CCCCC4
InChI=1SC21H29N3O2S3c113(2)28202218(271216(25)248657924)17141021(34)261115(14)2919(17)2320h13H512H214H3
MFCD04171684
ZINC000002419298
ZINC02419298
ZINC2419298
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