Vitas-M small molecule compound
2-{[2-(benzylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}-1-(4-chlorophenyl)ethanone
Catalog ID
STK720808
SMILES Clc1ccc(cc1)C(=O)CSc1nc(SCc2ccccc2)nc2c1c1CC(C)(C)OCc1s2
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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 C26H23ClN2O2S3 MW 527.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O2S3/c1-26(2)12-19-21(13-31-26)34-24-22(19)23(32-15-20(30)17-8-10-18(27)11-9-17)28-25(29-24)33-14-16-6-4-3-5-7-16/h3-11H,12-15H2,1-2H3InChIKey
IPQQQZSGPUPKLM-UHFFFAOYSA-NSynonyms
578757-75-22((2(benzylsulfanyl)66dimethyl58dihydro6Hpyrano(4345)thieno(23d)pyrimidin4yl)sulfanyl)1(4chlorophenyl)ethanone
2((2(benzylthio)66dimethyl68dihydro5Hpyrano(4345)thieno(23d)pyrimidin4yl)thio)1(4chlorophenyl)ethanone
2((2benzylsulfanyl66dimethyl58dihydropyrano(23)thieno(24b)pyrimidin4yl)sulfanyl)1(4chlorophenyl)ethanone
578757752
CC1(CC2=C(CO1)SC3=C2C(=NC(=N3)SCC4=CC=CC=C4)SCC(=O)C5=CC=C(C=C5)Cl)C
InChI=1SC26H23ClN2O2S3c126(2)121921(133126)342422(19)23(321520(30)1781018(27)11917)2825(2924)3314166435716h311H1215H212H3
MFCD04025664
ZINC000002374362
ZINC2374362
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