Vitas-M small molecule compound
2-[(2,5-dimethylbenzyl)sulfanyl]-3-(4-ethoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK554469
SMILES CCOc1ccc(cc1)n1c(SCc2cc(C)ccc2C)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 C27H28N2O2S2 MW 476.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O2S2/c1-4-31-21-13-11-20(12-14-21)29-26(30)24-22-7-5-6-8-23(22)33-25(24)28-27(29)32-16-19-15-17(2)9-10-18(19)3/h9-15H,4-8,16H2,1-3H3InChIKey
DFKBYKBVOYPASY-UHFFFAOYSA-NSynonyms
613226-82-72((25dimethylbenzyl)sulfanyl)3(4ethoxyphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2((25dimethylbenzyl)thio)3(4ethoxyphenyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2((25dimethylphenyl)methylsulfanyl)3(4ethoxyphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
613226827
CCOC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=C(C=CC(=C4)C)C)SC5=C3CCCC5
InChI=1SC27H28N2O2S2c143121131120(121421)2926(30)2422756823(22)3325(24)2827(29)3216191517(2)91018(19)3h915H4816H213H3
MFCD03474476
ZINC000002508626
ZINC02508626
ZINC2508626
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