Vitas-M small molecule compound
N-(4-acetylphenyl)-2-{[2-(benzylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]sulfanyl}acetamide
Catalog ID
STK554928
SMILES O=C(Nc1ccc(cc1)C(=O)C)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 C28H27N3O3S3 MW 549.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O3S3/c1-17(32)19-9-11-20(12-10-19)29-23(33)16-35-25-24-21-13-28(2,3)34-14-22(21)37-26(24)31-27(30-25)36-15-18-7-5-4-6-8-18/h4-12H,13-16H2,1-3H3,(H,29,33)InChIKey
NBZFCTUBOZEGHX-UHFFFAOYSA-NSynonyms
840485-58-7840485587
CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=NC3=C2C4=C(S3)COC(C4)(C)C)SCC5=CC=CC=C5
InChI=1SC28H27N3O3S3c117(32)1991120(121019)2923(33)16352524211328(23)341422(21)3726(24)3127(3025)3615187546818h412H1316H213H3(H2933)
MFCD04007617
N(4acetylphenyl)2((2(benzylsulfanyl)66dimethyl58dihydro6Hpyrano(4345)thieno(23d)pyrimidin4yl)sulfanyl)acetamide
N(4acetylphenyl)2((2(benzylthio)66dimethyl68dihydro5Hpyrano(4345)thieno(23d)pyrimidin4yl)thio)acetamide
N(4acetylphenyl)2((2benzylsulfanyl66dimethyl58dihydropyrano(23)thieno(24b)pyrimidin4yl)sulfanyl)acetamide
ZINC000002264968
ZINC2264968
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