Vitas-M small molecule compound
N-(2,4-dimethylphenyl)-2-{[3-(4-ethoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STK699365
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2C)C)nc2c(c1=O)c1CCCCc1s2
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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 C28H29N3O3S2 MW 519.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O3S2/c1-4-34-20-12-10-19(11-13-20)31-27(33)25-21-7-5-6-8-23(21)36-26(25)30-28(31)35-16-24(32)29-22-14-9-17(2)15-18(22)3/h9-15H,4-8,16H2,1-3H3,(H,29,32)InChIKey
YEAPCBLLHQXOPD-UHFFFAOYSA-NSynonyms
840470-29-3840470293
CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=C(C=C(C=C4)C)C)SC5=C3CCCC5
InChI=1SC28H29N3O3S2c143420121019(111320)3127(33)2521756823(21)3626(25)3028(31)351624(32)292214917(2)1518(22)3h915H4816H213H3(H2932)
MFCD03224577
N(24dimethylphenyl)2((3(4ethoxyphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(24dimethylphenyl)2((3(4ethoxyphenyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
N(24dimethylphenyl)2((3(4ethoxyphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000002260063
ZINC02260063
ZINC2260063
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